N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide
TL;DR: N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide (CAS 64468-32-2) is a chemical compound with molecular formula C20H12ClNO3 and molecular weight 349.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-3-oxobenzo[f]chromene-2-carboxamide
Also Known As: BAS 01019256, N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide, AN-512/12672036, N-(4-chlorophenyl)-3-oxobenzo[f]chromene-2-carboxamide, 3-Oxo-3H-benzo[f]chromene-2-carboxylic acid (4-chloro-phenyl)-amide
| Molecular Formula | C20H12ClNO3 |
|---|---|
| Molecular Weight | 349.05 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 349.05057 |
| Heavy Atoms | 25 |
| Complexity | 567.0 |
Chemical Identifiers
| CAS Number | 64468-32-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C=C(C(=O)O3)C(=O)NC4=CC=C(C=C4)Cl |
| InChIKey | HCHGXOWRPBFORM-UHFFFAOYSA-N |
Product Overview
N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide (CAS 64468-32-2), with molecular formula C20H12ClNO3 and molecular weight 349.05 g/mol. IUPAC: N-(4-chlorophenyl)-3-oxobenzo[f]chromene-2-carboxamide.
Chemical Property Profile of N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide
Property Insights of N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide
The XLogP value of 4.8 indicates that N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide has 1 hydrogen bond donor(s) and 3 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 N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide?
The CAS number of N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide is 64468-32-2.
What is the molecular formula of N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide?
The molecular formula of N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide is C20H12ClNO3.
What is the molecular weight of N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide?
The molecular weight of N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide is 349.05 g/mol.
Where can I buy N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide?
You can request a quote for N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-chlorophenyl)-3-oxo-3H-benzo[f]chromene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.