A3433/0145687
TL;DR: A3433/0145687 (CAS 380487-15-0) is a chemical compound with molecular formula C18H12N4O6S3 and molecular weight 475.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzoxazol-2-ylsulfanyl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]acetamide
Also Known As: A3433/0145687, 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]acetamide, 2-(1,3-benzoxazol-2-ylsulfanyl)-N-{5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}acetamide, 2-(1,3-BENZOXAZOL-2-YLSULFANYL)-N-[5-(4-NITROBENZENESULFONYL)-1,3-THIAZOL-2-YL]ACETAMIDE
| Molecular Formula | C18H12N4O6S3 |
|---|---|
| Molecular Weight | 475.99 g/mol |
| LogP | 3.7561 |
| Topological Polar Surface Area | 145.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 475.9919 |
| Heavy Atoms | 31 |
| Complexity | 1345.8279 |
Chemical Identifiers
| CAS Number | 380487-15-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)SCC(=O)NC3=NC=C(S3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
A3433/0145687 (CAS 380487-15-0), with molecular formula C18H12N4O6S3 and molecular weight 475.99 g/mol. IUPAC: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]acetamide.
Chemical Property Profile of A3433/0145687
Property Insights of A3433/0145687
The XLogP value of 3.7561 indicates that A3433/0145687 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.3 Ų indicates high polarity, suggesting A3433/0145687 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, A3433/0145687 has 1 hydrogen bond donor(s) and 10 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 A3433/0145687?
The CAS number of A3433/0145687 is 380487-15-0.
What is the molecular formula of A3433/0145687?
The molecular formula of A3433/0145687 is C18H12N4O6S3.
What is the molecular weight of A3433/0145687?
The molecular weight of A3433/0145687 is 475.99 g/mol.
Where can I buy A3433/0145687?
You can request a quote for A3433/0145687 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3433/0145687?
Yes, KEHONG BIO provides custom synthesis services for A3433/0145687 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.