Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate
TL;DR: Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate (CAS 332412-95-0) is a chemical compound with molecular formula C18H19ClN2O6 and molecular weight 394.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3-chlorophenyl)carbamoylamino]-3,4,5-trimethoxybenzoate
Also Known As: methyl 2-(3-(3-chlorophenyl)ureido)-3,4,5-trimethoxybenzoate, methyl 2-[(3-chlorophenyl)carbamoylamino]-3,4,5-trimethoxybenzoate, methyl 2-{[(3-chlorophenyl)amino]carbonylamino}-3,4,5-trimethoxybenzoate, methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate
| Molecular Formula | C18H19ClN2O6 |
|---|---|
| Molecular Weight | 394.09 g/mol |
| LogP | 3.7964 |
| Topological Polar Surface Area | 95.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 394.09317 |
| Heavy Atoms | 27 |
| Complexity | 855.9858 |
Chemical Identifiers
| CAS Number | 332412-95-0 |
|---|---|
| SMILES | COC1=C(C(=C(C(=C1)C(=O)OC)NC(=O)NC2=CC(=CC=C2)Cl)OC)OC |
Product Overview
Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate (CAS 332412-95-0), with molecular formula C18H19ClN2O6 and molecular weight 394.09 g/mol. IUPAC: methyl 2-[(3-chlorophenyl)carbamoylamino]-3,4,5-trimethoxybenzoate.
Chemical Property Profile of Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate
Property Insights of Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate
The XLogP value of 3.7964 indicates that Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.12 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate. Following Lipinski's Rule of Five, Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate has 2 hydrogen bond donor(s) and 6 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 Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate?
The CAS number of Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate is 332412-95-0.
What is the molecular formula of Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate?
The molecular formula of Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate is C18H19ClN2O6.
What is the molecular weight of Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate?
The molecular weight of Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate is 394.09 g/mol.
Where can I buy Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate?
You can request a quote for Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-{[(3-chlorophenyl)carbamoyl]amino}-3,4,5-trimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.