![Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate structure](/static/products/890/890579-81-4.png)
Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate
TL;DR: Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate (CAS 890579-81-4) is a chemical compound with molecular formula C17H18N2O5 and molecular weight 330.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(3,4-dimethoxyphenyl)carbamoylamino]benzoate
Also Known As: methyl 4-(3-(3,4-dimethoxyphenyl)ureido)benzoate, methyl 4-[(3,4-dimethoxyphenyl)carbamoylamino]benzoate, methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate, methyl 4-{[N-(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate, methyl 4-({[(3,4-dimethoxyphenyl)amino]carbonyl}amino)benzoate
| Molecular Formula | C17H18N2O5 |
|---|---|
| Molecular Weight | 330.12 g/mol |
| LogP | 3.1344 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.12158 |
| Heavy Atoms | 24 |
| Complexity | 728.2608 |
Chemical Identifiers
| CAS Number | 890579-81-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)NC(=O)NC2=CC=C(C=C2)C(=O)OC)OC |
Product Overview
Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate (CAS 890579-81-4), with molecular formula C17H18N2O5 and molecular weight 330.12 g/mol. IUPAC: methyl 4-[(3,4-dimethoxyphenyl)carbamoylamino]benzoate.
Chemical Property Profile of Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate
Property Insights of Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate
The XLogP value of 3.1344 indicates that Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate. Following Lipinski's Rule of Five, Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate has 2 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 Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate?
The CAS number of Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate is 890579-81-4.
What is the molecular formula of Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate?
The molecular formula of Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate is C17H18N2O5.
What is the molecular weight of Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate?
The molecular weight of Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate is 330.12 g/mol.
Where can I buy Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate?
You can request a quote for Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.