WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 535235
CAS#: 57471-01-9
Description: N 111 is a bioactive chemical.
MedKoo Cat#: 535235
Name: N 111
CAS#: 57471-01-9
Chemical Formula: C20H33N3O4
Exact Mass: 379.2471
Molecular Weight: 379.501
Elemental Analysis: C, 63.30; H, 8.77; N, 11.07; O, 16.86
This product is not in stock, which may be available by custom synthesis.
For cost-effective reason, minimum order is 1g (price is usually high, lead time is 2~3 months, depending on the technical challenge).
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Synonym: N 111; N-111; N111
IUPAC/Chemical Name: 3-(3-Acetyl-4-(3-(tert-butylamino)-2-hydroxypropoxy)phenyl)-1-(tert-butyl)urea
InChi Key: HJFOOUMUEFZBDQ-UHFFFAOYSA-N
InChi Code: InChI=1S/C20H33N3O4/c1-13(24)16-10-14(22-18(26)23-20(5,6)7)8-9-17(16)27-12-15(25)11-21-19(2,3)4/h8-10,15,21,25H,11-12H2,1-7H3,(H2,22,23,26)
SMILES Code: O=C(NC1=CC=C(OCC(O)CNC(C)(C)C)C(C(C)=O)=C1)NC(C)(C)C
Appearance: Solid powder
Purity: >98% (or refer to the Certificate of Analysis)
Shipping Condition: Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition: Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility: Soluble in DMSO
Shelf Life: >3 years if stored properly
Drug Formulation: This drug may be formulated in DMSO
Stock Solution Storage: 0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code: 2934.99.9001
The following data is based on the product molecular weight 379.501 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.
| Concentration / Solvent Volume / Mass | 1 mg | 5 mg | 10 mg |
|---|---|---|---|
| 1 mM | 1.15 mL | 5.76 mL | 11.51 mL |
| 5 mM | 0.23 mL | 1.15 mL | 2.3 mL |
| 10 mM | 0.12 mL | 0.58 mL | 1.15 mL |
| 50 mM | 0.02 mL | 0.12 mL | 0.23 mL |
1: Shahed SMF, Beniya A, Hirata H, Watanabe Y. Morphology of size-selected Ptn clusters on CeO2(111). J Chem Phys. 2018 Mar 21;148(11):114702. doi: 10.1063/1.5017906. PMID: 29566501.
2: Leung K. 111In- Tetraazacyclododecane-N,N',N'',N'''-tetraacetic acid-Phe(4-NO2)-cyclo(D-Cys-Tyr-D-Trp-Lys-Thr-Cys)-D-Tyr- NH2. 2009 Sep 5 [updated 2009 Oct 15]. In: Molecular Imaging and Contrast Agent Database (MICAD) [Internet]. Bethesda (MD): National Center for Biotechnology Information (US); 2004–2013. PMID: 20641841.
3: Cheng KT. [111In-1,4,7,10-Tetraazacyclododecane-N,N' ,N'',N'''-tetraacetic acid- Pro1,Tyr4]Bombesin. 2007 Oct 23 [updated 2007 Nov 13]. In: Molecular Imaging and Contrast Agent Database (MICAD) [Internet]. Bethesda (MD): National Center for Biotechnology Information (US); 2004–2013. PMID: 20641605.
4: Cheng KT. 111In- Tetraazacyclododecane-N,N’,N’’,N’’’-tetraacetic acid-HHEAYGWMDF-NH2 peptide. 2007 Apr 23 [updated 2008 Apr 3]. In: Molecular Imaging and Contrast Agent Database (MICAD) [Internet]. Bethesda (MD): National Center for Biotechnology Information (US); 2004–2013. PMID: 20641328.
5: Cheng KT. 111In- Tetraazacyclododecane-N,N’,N’’,N’’’-tetraacetic acid-HHHHHH-EAYGWMDF-NH2 peptide. 2007 Apr 23 [updated 2008 Apr 3]. In: Molecular Imaging and Contrast Agent Database (MICAD) [Internet]. Bethesda (MD): National Center for Biotechnology Information (US); 2004–2013. PMID: 20641278.
6: Leung K. 111In- Tetraazacyclododecane-N,N',N'',N'''-tetraacetic acid-c(D-Cys-Phe-Tyr-D-AgI8(Me,2-naphthoyl)-Lys-Thr-Phe-Cys)-OH. 2009 Aug 5 [updated 2009 Oct 15]. In: Molecular Imaging and Contrast Agent Database (MICAD) [Internet]. Bethesda (MD): National Center for Biotechnology Information (US); 2004–2013. PMID: 20641886.
