WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 597910
Description: JMV-1645 is a potent and selective B(1) bradykinin receptor antagonist.
MedKoo Cat#: 597910
Chemical Formula: C49H69N13O12S
Exact Mass: 1063.4909
Molecular Weight: 1064.23
Elemental Analysis: C, 55.30; H, 6.54; N, 17.11; O, 18.04; S, 3.01
This product is not in stock, which may be available by custom synthesis.
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Synonym: JMV-1645; JMV 1645; JMV1645;
IUPAC/Chemical Name: 2-((3S)-3-(2-(2-((2S,4R)-1-(L-lysyl-L-arginyl-L-prolyl)-4-hydroxypyrrolidine-2-carboxamido)acetamido)-N-((S)-1-amino-3-hydroxy-1-oxopropan-2-yl)-2-(2,3-dihydro-1H-inden-2-yl)acetamido)-4-oxo-3,4-dihydrobenzo[b][1,4]thiazepin-5(2H)-yl)acetic acid
InChi Key: FXTFICQJMBHGPE-XMLMJMRQSA-N
InChi Code: InChI=1S/C49H69N13O12S/c50-16-6-5-11-31(51)43(69)57-32(12-7-17-55-49(53)54)45(71)59-18-8-14-34(59)46(72)60-23-30(64)21-35(60)44(70)56-22-39(65)58-41(29-19-27-9-1-2-10-28(27)20-29)48(74)62(36(25-63)42(52)68)37-26-75-38-15-4-3-13-33(38)61(47(37)73)24-40(66)67/h1-4,9-10,13,15,29-32,34-37,41,63-64H,5-8,11-12,14,16-26,50-51H2,(H2,52,68)(H,56,70)(H,57,69)(H,58,65)(H,66,67)(H4,53,54,55)/t30-,31+,32+,34+,35+,36+,37-,41?/m1/s1
SMILES Code: OC[C@@H](C(N)=O)N(C(C(C1CC2=C(C=CC=C2)C1)NC(CNC([C@H]3N(C([C@H]4N(C([C@H](CCCNC(N)=N)NC([C@H](CCCCN)N)=O)=O)CCC4)=O)C[C@H](O)C3)=O)=O)=O)[C@@H]5CSC6=CC=CC=C6N(CC(O)=O)C5=O
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: 2934.99.03.00
The following data is based on the product molecular weight 1064.23 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: Bedos P, Amblard M, Subra G, Dodey P, Luccarini JM, Paquet JL, Pruneau D, Aumelas A, Martinez J. A rational approach to the design and synthesis of a new bradykinin B(1) receptor antagonist. J Med Chem. 2000 Jun 15;43(12):2387-94. PubMed PMID: 10882365.