Utibaprilat
TL;DR: Utibaprilat (CAS 109683-79-6) is a chemical compound with molecular formula C20H27N3O5S and molecular weight 421.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-5-tert-butyl-3-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]propanoyl]-2H-1,3,4-thiadiazole-2-carboxylic acid
Also Known As: Utibaprilat, utibaprilate, utibaprilatum, Utibaprirat, Utibaprilat [INN:BAN]
| Molecular Formula | C20H27N3O5S |
|---|---|
| Molecular Weight | 421.17 g/mol |
| LogP | 2.3962 |
| Topological Polar Surface Area | 119.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 421.16714 |
| Heavy Atoms | 29 |
| Complexity | 791.05646 |
Chemical Identifiers
| CAS Number | 109683-79-6 |
|---|---|
| SMILES | C[C@@H](C(=O)N1[C@@H](SC(=N1)C(C)(C)C)C(=O)O)N[C@@H](CCC2=CC=CC=C2)C(=O)O |
Product Overview
Utibaprilat (CAS 109683-79-6), with molecular formula C20H27N3O5S and molecular weight 421.17 g/mol. IUPAC: (2S)-5-tert-butyl-3-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]propanoyl]-2H-1,3,4-thiadiazole-2-carboxylic acid.
Chemical Property Profile of Utibaprilat
Property Insights of Utibaprilat
The XLogP value of 2.3962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Utibaprilat. The TPSA of 119.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Utibaprilat. Following Lipinski's Rule of Five, Utibaprilat has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Utibaprilat?
The CAS number of Utibaprilat is 109683-79-6.
What is the molecular formula of Utibaprilat?
The molecular formula of Utibaprilat is C20H27N3O5S.
What is the molecular weight of Utibaprilat?
The molecular weight of Utibaprilat is 421.17 g/mol.
Where can I buy Utibaprilat?
You can request a quote for Utibaprilat directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Utibaprilat?
Yes, KEHONG BIO provides custom synthesis services for Utibaprilat and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.