(S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate
TL;DR: (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate (CAS 1173669-80-1) is a chemical compound with molecular formula C18H20N2O3 and molecular weight 312.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[(2-methylphenyl)carbamoylamino]-3-phenylpropanoate
Also Known As: (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate, methyl (2S)-2-[(2-methylphenyl)carbamoylamino]-3-phenylpropanoate
| Molecular Formula | C18H20N2O3 |
|---|---|
| Molecular Weight | 312.15 g/mol |
| LogP | 2.90082 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.1474 |
| Heavy Atoms | 23 |
| Complexity | 670.97675 |
Chemical Identifiers
| CAS Number | 1173669-80-1 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC |
Product Overview
(S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate (CAS 1173669-80-1), with molecular formula C18H20N2O3 and molecular weight 312.15 g/mol. IUPAC: methyl (2S)-2-[(2-methylphenyl)carbamoylamino]-3-phenylpropanoate.
Chemical Property Profile of (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate
Property Insights of (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate
The XLogP value of 2.90082 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate. Following Lipinski's Rule of Five, (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate 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 (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate?
The CAS number of (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate is 1173669-80-1.
What is the molecular formula of (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate?
The molecular formula of (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate is C18H20N2O3.
What is the molecular weight of (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate?
The molecular weight of (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate is 312.15 g/mol.
Where can I buy (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate?
You can request a quote for (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-methyl 3-phenyl-2-(3-(o-tolyl)ureido)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.