G857-0078
TL;DR: G857-0078 (CAS 933230-67-2) is a chemical compound with molecular formula C19H21N3O4S and molecular weight 387.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinazolin-4-yl)sulfanyl]acetyl]amino]benzoate
Also Known As: G857-0078, F2684-0059, ethyl 2-{2-[(2-oxo-1,2,5,6,7,8-hexahydroquinazolin-4-yl)sulfanyl]acetamido}benzoate, ethyl 2-[[2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinazolin-4-yl)sulfanyl]acetyl]amino]benzoate, ethyl 2-({[(2-oxo-1,2,5,6,7,8-hexahydroquinazolin-4-yl)thio]acetyl}amino)benzoate
| Molecular Formula | C19H21N3O4S |
|---|---|
| Molecular Weight | 387.13 g/mol |
| LogP | 2.5562 |
| Topological Polar Surface Area | 101.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.12527 |
| Heavy Atoms | 27 |
| Complexity | 910.06805 |
Chemical Identifiers
| CAS Number | 933230-67-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC=CC=C1NC(=O)CSC2=NC(=O)NC3=C2CCCC3 |
Product Overview
G857-0078 (CAS 933230-67-2), with molecular formula C19H21N3O4S and molecular weight 387.13 g/mol. IUPAC: ethyl 2-[[2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinazolin-4-yl)sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of G857-0078
Property Insights of G857-0078
The XLogP value of 2.5562 suggests moderate lipophilicity, balancing water solubility and membrane permeability for G857-0078. The TPSA of 101.15 Ų falls within the moderate polarity range, balancing permeability and solubility for G857-0078. Following Lipinski's Rule of Five, G857-0078 has 2 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 G857-0078?
The CAS number of G857-0078 is 933230-67-2.
What is the molecular formula of G857-0078?
The molecular formula of G857-0078 is C19H21N3O4S.
What is the molecular weight of G857-0078?
The molecular weight of G857-0078 is 387.13 g/mol.
Where can I buy G857-0078?
You can request a quote for G857-0078 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for G857-0078?
Yes, KEHONG BIO provides custom synthesis services for G857-0078 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.