G857-0031
TL;DR: G857-0031 (CAS 959535-31-0) is a chemical compound with molecular formula C17H18ClN3O2S and molecular weight 363.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-2-methylphenyl)-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinazolin-4-yl)sulfanyl]acetamide
Also Known As: G857-0031, F2684-0008, N-(3-chloro-2-methylphenyl)-2-[(2-oxo-1,2,5,6,7,8-hexahydroquinazolin-4-yl)sulfanyl]acetamide, N-(3-chloro-2-methylphenyl)-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinazolin-4-yl)sulfanyl]acetamide, N-(3-chloro-2-methylphenyl)-2-((2-oxo-1,2,5,6,7,8-hexahydroquinazolin-4-yl)thio)acetamide
| Molecular Formula | C17H18ClN3O2S |
|---|---|
| Molecular Weight | 363.08 g/mol |
| LogP | 3.34132 |
| Topological Polar Surface Area | 74.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.0808 |
| Heavy Atoms | 24 |
| Complexity | 835.07074 |
Chemical Identifiers
| CAS Number | 959535-31-0 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NC(=O)CSC2=NC(=O)NC3=C2CCCC3 |
Product Overview
G857-0031 (CAS 959535-31-0), with molecular formula C17H18ClN3O2S and molecular weight 363.08 g/mol. IUPAC: N-(3-chloro-2-methylphenyl)-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinazolin-4-yl)sulfanyl]acetamide.
Chemical Property Profile of G857-0031
Property Insights of G857-0031
The XLogP value of 3.34132 indicates that G857-0031 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.85 Ų falls within the moderate polarity range, balancing permeability and solubility for G857-0031. Following Lipinski's Rule of Five, G857-0031 has 2 hydrogen bond donor(s) and 4 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 G857-0031?
The CAS number of G857-0031 is 959535-31-0.
What is the molecular formula of G857-0031?
The molecular formula of G857-0031 is C17H18ClN3O2S.
What is the molecular weight of G857-0031?
The molecular weight of G857-0031 is 363.08 g/mol.
Where can I buy G857-0031?
You can request a quote for G857-0031 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for G857-0031?
Yes, KEHONG BIO provides custom synthesis services for G857-0031 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.