Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester
TL;DR: Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester (CAS 70974-14-0) is a chemical compound with molecular formula C12H15FN2O3 and molecular weight 254.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(4-fluorophenyl)carbamoylamino]-2-methylpropanoate
Also Known As: Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester, N-((p-Fluorophenyl)carbamoyl)-2-methylalanine methyl ester, methyl 2-[(4-fluorophenyl)carbamoylamino]-2-methylpropanoate, methyl2-[ carbamoylamino]-2-methyl-propanoate, Alanine, N-(((4-fluorophenyl)amino)carbonyl)-2-methyl-, methyl ester
| Molecular Formula | C12H15FN2O3 |
|---|---|
| Molecular Weight | 254.11 g/mol |
| LogP | 1.8988 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.10667 |
| Heavy Atoms | 18 |
| Complexity | 443.1407 |
Chemical Identifiers
| CAS Number | 70974-14-0 |
|---|---|
| SMILES | CC(C)(C(=O)OC)NC(=O)NC1=CC=C(C=C1)F |
Product Overview
Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester (CAS 70974-14-0), with molecular formula C12H15FN2O3 and molecular weight 254.11 g/mol. IUPAC: methyl 2-[(4-fluorophenyl)carbamoylamino]-2-methylpropanoate.
Chemical Property Profile of Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester
Property Insights of Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester
The XLogP value of 1.8988 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester. Following Lipinski's Rule of Five, Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester 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 Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester?
The CAS number of Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester is 70974-14-0.
What is the molecular formula of Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester?
The molecular formula of Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester is C12H15FN2O3.
What is the molecular weight of Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester?
The molecular weight of Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester is 254.11 g/mol.
Where can I buy Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester?
You can request a quote for Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Alanine, N-((p-fluorophenyl)carbamoyl)-2-methyl-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.