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MedKoo Cat#: 597321 | Name: S 863390

Description:

WARNING: This product is for research use only, not for human or veterinary use.

S 863390 is a renin inhibitor.

Chemical Structure

S 863390
S 863390
CAS#130024-92-9

Theoretical Analysis

MedKoo Cat#: 597321

Name: S 863390

CAS#: 130024-92-9

Chemical Formula: C37H52N6O4

Exact Mass: 644.4050

Molecular Weight: 644.86

Elemental Analysis: C, 68.92; H, 8.13; N, 13.03; O, 9.92

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
No Data
Synonym
S 863390; S-863390; S863390; S 86,3390; S-86,3390 S86,3390;
IUPAC/Chemical Name
N-((S)-1-(((S)-1-amino-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl)((2S,3S)-1-cyclohexyl-3-hydroxy-6-(pyridin-2-yl)hexan-2-yl)amino)-1-oxo-3-phenylpropan-2-yl)-3-methylbutanamide
InChi Key
GSANUXXPZGRAIH-CUPIEXAXSA-N
InChi Code
InChI=1S/C37H52N6O4/c1-26(2)20-35(45)42-31(21-27-12-5-3-6-13-27)37(47)43(33(36(38)46)23-30-24-39-25-41-30)32(22-28-14-7-4-8-15-28)34(44)18-11-17-29-16-9-10-19-40-29/h3,5-6,9-10,12-13,16,19,24-26,28,31-34,44H,4,7-8,11,14-15,17-18,20-23H2,1-2H3,(H2,38,46)(H,39,41)(H,42,45)/t31-,32-,33-,34-/m0/s1
SMILES Code
O=C(N)[C@H](CC1=CNC=N1)N(C([C@H](CC2=CC=CC=C2)NC(CC(C)C)=O)=O)[C@@H](CC3CCCCC3)[C@@H](O)CCCC4=NC=CC=C4
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
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 644.86 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.

Recalculate based on batch purity %
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: Kramer W, Girbig F, Gutjahr U, Kleemann HW, Leipe I, Urbach H, Wagner A. Interaction of renin inhibitors with the intestinal uptake system for oligopeptides and beta-lactam antibiotics. Biochim Biophys Acta. 1990 Aug 10;1027(1):25-30. PubMed PMID: 2204426.

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