Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate
TL;DR: Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate (CAS 893107-25-0) is a chemical compound with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(cyclopropylcarbamoylamino)benzoate
Also Known As: Methyl 2-(cyclopropylcarbamoylamino)benzoate, methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate, methyl 2-[(N-cyclopropylcarbamoyl)amino]benzoate, methyl 2-(((cyclopropylamino)carbonyl)amino)benzoate
| Molecular Formula | C12H14N2O3 |
|---|---|
| Molecular Weight | 234.10 g/mol |
| LogP | 1.7571 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.10045 |
| Heavy Atoms | 17 |
| Complexity | 441.1318 |
Chemical Identifiers
| CAS Number | 893107-25-0 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1NC(=O)NC2CC2 |
Product Overview
Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate (CAS 893107-25-0), with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol. IUPAC: methyl 2-(cyclopropylcarbamoylamino)benzoate.
Chemical Property Profile of Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate
Property Insights of Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate
The XLogP value of 1.7571 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate. Following Lipinski's Rule of Five, Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate has 2 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 Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate?
The CAS number of Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate is 893107-25-0.
What is the molecular formula of Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate?
The molecular formula of Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate is C12H14N2O3.
What is the molecular weight of Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate?
The molecular weight of Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate is 234.10 g/mol.
Where can I buy Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate?
You can request a quote for Methyl 2-{[(cyclopropylamino)carbonyl]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 2-{[(cyclopropylamino)carbonyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-{[(cyclopropylamino)carbonyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.