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MedKoo Cat#: 524722 | Name: CI 992

Description:

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

CI 992 is a novel potent inhibitor of primate renin.

Chemical Structure

CI 992
CI 992
CAS#135704-06-2

Theoretical Analysis

MedKoo Cat#: 524722

Name: CI 992

CAS#: 135704-06-2

Chemical Formula: C33H52N6O7S2

Exact Mass: 708.3339

Molecular Weight: 708.93

Elemental Analysis: C, 55.91; H, 7.39; N, 11.85; O, 15.80; S, 9.05

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
CI 992; CI992; CI-992.
IUPAC/Chemical Name
(S)-3-(2-aminothiazol-4-yl)-2-(((2S,3R,4S)-1-cyclohexyl-3,4-dihydroxy-6-methylheptan-2-yl)amino)-N-((S)-2-(morpholine-4-sulfonamido)-3-phenylpropanoyl)propanamide
InChi Key
IYMYORIPWWCOOB-VFFRCKCKSA-N
InChi Code
InChI=1S/C33H52N6O7S2/c1-22(2)17-29(40)30(41)26(18-23-9-5-3-6-10-23)36-27(20-25-21-47-33(34)35-25)31(42)37-32(43)28(19-24-11-7-4-8-12-24)38-48(44,45)39-13-15-46-16-14-39/h4,7-8,11-12,21-23,26-30,36,38,40-41H,3,5-6,9-10,13-20H2,1-2H3,(H2,34,35)(H,37,42,43)/t26-,27-,28-,29-,30+/m0/s1
SMILES Code
C([C@@H](N[C@H]([C@H]([C@H](CC(C)C)O)O)CC1CCCCC1)Cc1nc(sc1)N)(=O)NC([C@@H](NS(=O)(=O)N1CCOCC1)Cc1ccccc1)=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, not in water
Shelf Life
>2 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
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 708.93 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: Cook JA, Burger PJ, Michniewicz BM, Nordblom GD, Hicks GW, Kaplan C, Ryan MJ. Pharmacokinetics and pharmacodynamics of CI-992 following intravenous and oral administration to cynomolgus monkeys. Biopharm Drug Dispos. 1998 Apr;19(3):185-91. PubMed PMID: 9570002. 2: Ryan MJ, Hicks GW, Batley BL, Rapundalo ST, Patt WC, Taylor DG, Keiser JA. Effect of an orally active renin inhibitor Cl-992 on blood pressure in normotensive and hypertensive monkeys. J Pharmacol Exp Ther. 1994 Jan;268(1):372-9. PubMed PMID: 8301578.