RefChem:1091121
TL;DR: RefChem:1091121 (CAS 4903-36-0) is a chemical compound with molecular formula C16H15Cl2NO4 and molecular weight 355.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-[(3,5-dichlorophenyl)carbamoyl]-6-hydroxycyclohexa-1,3-diene-1-carboxylate
Also Known As: Ethyl 2-(((3,5-dichlorophenyl)amino)carbonyl)-2-hydroxybenzoate, ethyl 6-[(3,5-dichlorophenyl)carbamoyl]-6-hydroxycyclohexa-1,3-diene-1-carboxylate, Benzoic acid, 2-(((3,5-dichlorophenyl)amino)carbonyl)-2-hydroxy-, ethyl ester, N-(3,5-Dichlorophenyl)-2-(ethoxycarbonyl)-1-hydroxycyclohexa-2,4-diene-1-carboximidic acid, RefChem:1091121
| Molecular Formula | C16H15Cl2NO4 |
|---|---|
| Molecular Weight | 355.04 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 355.0378 |
| Heavy Atoms | 23 |
| Complexity | 524.0 |
Chemical Identifiers
| CAS Number | 4903-36-0 |
|---|---|
| SMILES | CCOC(=O)C1=CC=CCC1(C(=O)NC2=CC(=CC(=C2)Cl)Cl)O |
| InChIKey | IARICXOFTCUCMC-UHFFFAOYSA-N |
Product Overview
RefChem:1091121 (CAS 4903-36-0), with molecular formula C16H15Cl2NO4 and molecular weight 355.04 g/mol. IUPAC: ethyl 6-[(3,5-dichlorophenyl)carbamoyl]-6-hydroxycyclohexa-1,3-diene-1-carboxylate.
Chemical Property Profile of RefChem:1091121
Property Insights of RefChem:1091121
The XLogP value of 3.7 indicates that RefChem:1091121 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1091121. Following Lipinski's Rule of Five, RefChem:1091121 has 2 hydrogen bond donor(s) and 4 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 RefChem:1091121?
The CAS number of RefChem:1091121 is 4903-36-0.
What is the molecular formula of RefChem:1091121?
The molecular formula of RefChem:1091121 is C16H15Cl2NO4.
What is the molecular weight of RefChem:1091121?
The molecular weight of RefChem:1091121 is 355.04 g/mol.
Where can I buy RefChem:1091121?
You can request a quote for RefChem:1091121 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1091121?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1091121 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.