(S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate
TL;DR: (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate (CAS 1173666-37-9) is a chemical compound with molecular formula C12H15ClN2O3 and molecular weight 270.07712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (2S)-2-[(4-chlorophenyl)methylcarbamoylamino]propanoate
Also Known As: (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate, methyl (2S)-2-[(4-chlorophenyl)methylcarbamoylamino]propanoate
Technical Specifications
| Molecular Formula | C12H15ClN2O3 |
| Molecular Weight | 270.07712 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.07712 Da |
| Heavy Atoms | 18 |
| Complexity | 291.0 |
| SMILES | C[C@@H](C(=O)OC)NC(=O)NCC1=CC=C(C=C1)Cl |
| InChIKey | YRIRXZIBKNRYGS-QMMMGPOBSA-N |
Chemical Property Profile of (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate
Property Insights of (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate. Following Lipinski's Rule of Five, (S)-methyl 2-(3-(4-chlorobenzyl)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
What is the CAS number of (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate?
The CAS number of (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate is 1173666-37-9.
What is the molecular formula of (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate?
The molecular formula of (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate is C12H15ClN2O3.
What is the molecular weight of (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate?
The molecular weight of (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate is 270.07712 g/mol.
Where can I buy (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate?
You can request a quote for (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate?
Yes, CoreyChem provides custom synthesis services for (S)-methyl 2-(3-(4-chlorobenzyl)ureido)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.