2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate
TL;DR: 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate (CAS 7121-10-0) is a chemical compound with molecular formula C21H18ClNO5 and molecular weight 399.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]naphthalen-2-yl] acetate
Also Known As: Naphthol AS-LC acetate, Naphthol-AS-LC-Acetat, NAPHTHOL AS-CL ACETATE, 1-bromo-2-(diethoxymethyl)benzene, 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate
| Molecular Formula | C21H18ClNO5 |
|---|---|
| Molecular Weight | 399.09 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 73.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 399.08734 |
| Heavy Atoms | 28 |
| Complexity | 559.0 |
Chemical Identifiers
| CAS Number | 7121-10-0 |
|---|---|
| SMILES | CC(=O)OC1=CC2=CC=CC=C2C=C1C(=O)NC3=CC(=C(C=C3OC)Cl)OC |
| InChIKey | JICRDMOKQCCJEN-UHFFFAOYSA-N |
Product Overview
2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate (CAS 7121-10-0), with molecular formula C21H18ClNO5 and molecular weight 399.09 g/mol. IUPAC: [3-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]naphthalen-2-yl] acetate.
Chemical Property Profile of 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate
Property Insights of 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate
The XLogP value of 4.3 indicates that 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate. Following Lipinski's Rule of Five, 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate has 1 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 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate?
The CAS number of 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate is 7121-10-0.
What is the molecular formula of 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate?
The molecular formula of 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate is C21H18ClNO5.
What is the molecular weight of 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate?
The molecular weight of 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate is 399.09 g/mol.
Where can I buy 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate?
You can request a quote for 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(N-(4-Chloro-2,5-dimethoxyphenyl)carbamoyl)-3-naphthyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.