1-chloro-2-benzamidoanthraquinone
TL;DR: 1-chloro-2-benzamidoanthraquinone (CAS 62956-89-2) is a chemical compound with molecular formula C21H12ClNO3 and molecular weight 361.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-chloro-9,10-dioxoanthracen-2-yl)benzamide
Also Known As: 1-chloro-2-benzamidoanthraquinone, N-(1-chloro-9,10-dioxoanthracen-2-yl)benzamide, BAS 00336685, BIM-0015612.P001, N-(1-chloro-9,10-dioxo-9,10-dihydroanthracen-2-yl)benzamide
| Molecular Formula | C21H12ClNO3 |
|---|---|
| Molecular Weight | 361.05 g/mol |
| LogP | 4.3677 |
| Topological Polar Surface Area | 63.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 361.05057 |
| Heavy Atoms | 26 |
| Complexity | 1073.8693 |
Chemical Identifiers
| CAS Number | 62956-89-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC2=C(C3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)Cl |
Product Overview
1-chloro-2-benzamidoanthraquinone (CAS 62956-89-2), with molecular formula C21H12ClNO3 and molecular weight 361.05 g/mol. IUPAC: N-(1-chloro-9,10-dioxoanthracen-2-yl)benzamide.
Chemical Property Profile of 1-chloro-2-benzamidoanthraquinone
Property Insights of 1-chloro-2-benzamidoanthraquinone
The XLogP value of 4.3677 indicates that 1-chloro-2-benzamidoanthraquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-chloro-2-benzamidoanthraquinone. Following Lipinski's Rule of Five, 1-chloro-2-benzamidoanthraquinone 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 1-chloro-2-benzamidoanthraquinone?
The CAS number of 1-chloro-2-benzamidoanthraquinone is 62956-89-2.
What is the molecular formula of 1-chloro-2-benzamidoanthraquinone?
The molecular formula of 1-chloro-2-benzamidoanthraquinone is C21H12ClNO3.
What is the molecular weight of 1-chloro-2-benzamidoanthraquinone?
The molecular weight of 1-chloro-2-benzamidoanthraquinone is 361.05 g/mol.
Where can I buy 1-chloro-2-benzamidoanthraquinone?
You can request a quote for 1-chloro-2-benzamidoanthraquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-chloro-2-benzamidoanthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 1-chloro-2-benzamidoanthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.