![methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate structure](/static/products/117/1173675-75-6.png)
methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate
TL;DR: methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate (CAS 1173675-75-6) is a chemical compound with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2R)-2-[(4-methylphenyl)carbamoylamino]propanoate
Also Known As: (R)-methyl 2-(3-(p-tolyl)ureido)propanoate, methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate, methyl (2R)-2-[(4-methylphenyl)carbamoylamino]propanoate
| Molecular Formula | C12H16N2O3 |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | 1.67802 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.11609 |
| Heavy Atoms | 17 |
| Complexity | 400.7167 |
Chemical Identifiers
| CAS Number | 1173675-75-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)N[C@H](C)C(=O)OC |
Product Overview
methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate (CAS 1173675-75-6), with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol. IUPAC: methyl (2R)-2-[(4-methylphenyl)carbamoylamino]propanoate.
Chemical Property Profile of methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate
Property Insights of methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate
The XLogP value of 1.67802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate. Following Lipinski's Rule of Five, methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate 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 N-[(4-methylphenyl)carbamoyl]-D-alaninate?
The CAS number of methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate is 1173675-75-6.
What is the molecular formula of methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate?
The molecular formula of methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate is C12H16N2O3.
What is the molecular weight of methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate?
The molecular weight of methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate is 236.12 g/mol.
Where can I buy methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate?
You can request a quote for methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[(4-methylphenyl)carbamoyl]-D-alaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.