BAS 03539003
TL;DR: BAS 03539003 (CAS 797809-99-5) is a chemical compound with molecular formula C21H18ClN3O4 and molecular weight 411.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(4-acetamidoanilino)-2-(4-chlorophenyl)-2-oxoethyl]furan-2-carboxamide
Also Known As: BAS 03539003, N-[2-(4-chlorophenyl)-1-[(4-acetamidophenyl)amino]-2-oxoethyl]furan-2-carboxamide, N-[1-(4-acetamidoanilino)-2-(4-chlorophenyl)-2-oxoethyl]furan-2-carboxamide, N-[1-{[4-(acetylamino)phenyl]amino}-2-(4-chlorophenyl)-2-oxoethyl]furan-2-carboxamide
| Molecular Formula | C21H18ClN3O4 |
|---|---|
| Molecular Weight | 411.10 g/mol |
| LogP | 3.9423 |
| Topological Polar Surface Area | 100.44 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 411.09857 |
| Heavy Atoms | 29 |
| Complexity | 999.42017 |
Chemical Identifiers
| CAS Number | 797809-99-5 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)NC(C(=O)C2=CC=C(C=C2)Cl)NC(=O)C3=CC=CO3 |
Product Overview
BAS 03539003 (CAS 797809-99-5), with molecular formula C21H18ClN3O4 and molecular weight 411.10 g/mol. IUPAC: N-[1-(4-acetamidoanilino)-2-(4-chlorophenyl)-2-oxoethyl]furan-2-carboxamide.
Chemical Property Profile of BAS 03539003
Property Insights of BAS 03539003
The XLogP value of 3.9423 indicates that BAS 03539003 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.44 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03539003. Following Lipinski's Rule of Five, BAS 03539003 has 3 hydrogen bond donor(s) and 5 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 BAS 03539003?
The CAS number of BAS 03539003 is 797809-99-5.
What is the molecular formula of BAS 03539003?
The molecular formula of BAS 03539003 is C21H18ClN3O4.
What is the molecular weight of BAS 03539003?
The molecular weight of BAS 03539003 is 411.10 g/mol.
Where can I buy BAS 03539003?
You can request a quote for BAS 03539003 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03539003?
Yes, KEHONG BIO provides custom synthesis services for BAS 03539003 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.