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MedKoo Cat#: 597875 | Name: SQ 27786

Description:

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

SQ 27786 is an ACE inhibitor.

Chemical Structure

SQ 27786
SQ 27786
CAS#89813-31-0

Theoretical Analysis

MedKoo Cat#: 597875

Name: SQ 27786

CAS#: 89813-31-0

Chemical Formula: C23H25ClN4O7S2

Exact Mass: 568.0853

Molecular Weight: 569.04

Elemental Analysis: C, 48.55; H, 4.43; Cl, 6.23; N, 9.85; O, 19.68; S, 11.27

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
SQ 27786; SQ-27786; SQ27786; SQ 27,786; SQ-27,786; SQ27,786;
IUPAC/Chemical Name
(2S)-4-(4-(7-chloro-4-oxo-6-sulfamoyl-1,2,3,4-tetrahydroquinazolin-2-yl)phenoxy)-1-(3-mercapto-2-methylpropanoyl)pyrrolidine-2-carboxylic acid
InChi Key
QTTPYECWSCVAOK-GONQBWSISA-N
InChi Code
InChI=1S/C23H25ClN4O7S2/c1-11(10-36)22(30)28-9-14(6-18(28)23(31)32)35-13-4-2-12(3-5-13)20-26-17-8-16(24)19(37(25,33)34)7-15(17)21(29)27-20/h2-5,7-8,11,14,18,20,26,36H,6,9-10H2,1H3,(H,27,29)(H,31,32)(H2,25,33,34)/t11?,14?,18-,20?/m0/s1
SMILES Code
O=C(O)[C@H]1N(C(C(C)CS)=O)CC(OC2=CC=C(C(N3)NC4=C(C=C(S(=O)(N)=O)C(Cl)=C4)C3=O)C=C2)C1
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 569.04 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: DeForrest JM, Waldron TL, Powell JR, Floyd DM, Sundeen JE. SQ 27,786 and SQ 28,853: two angiotensin converting enzyme inhibitors with potent diuretic activity. J Cardiovasc Pharmacol. 1987 Feb;9(2):154-9. PubMed PMID: 2435992. 2: Everett DW, Singhvi SM, DeForrest JM, Morrison RA, Weinstein SH, Migdalof BH. Relationship between metabolism and pharmacologic activity of SQ 27,786, an angiotensin converting enzyme inhibitor with potent diuretic activity. Drug Des Deliv. 1987 Sep;2(1):23-34. PubMed PMID: 3509342.