![methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate structure](/static/products/117/1173662-48-0.webp)
methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate
TL;DR: methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate (CAS 1173662-48-0) is a chemical compound with molecular formula C13H17N3O4 and molecular weight 279.12192 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (2S)-2-[(3-acetamidophenyl)carbamoylamino]propanoate
Also Known As: (S)-methyl 2-(3-(3-acetamidophenyl)ureido)propanoate, methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate
Technical Specifications
| Molecular Formula | C13H17N3O4 |
| Molecular Weight | 279.12192 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 96.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 279.12192 Da |
| Heavy Atoms | 20 |
| Complexity | 373.0 |
| SMILES | C[C@@H](C(=O)OC)NC(=O)NC1=CC=CC(=C1)NC(=O)C |
| InChIKey | HOOHSXKUZWHBRC-QMMMGPOBSA-N |
Chemical Property Profile of methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate
Property Insights of methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate. Following Lipinski's Rule of Five, methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate?
The CAS number of methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate is 1173662-48-0.
What is the molecular formula of methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate?
The molecular formula of methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate is C13H17N3O4.
What is the molecular weight of methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate?
The molecular weight of methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate is 279.12192 g/mol.
Where can I buy methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate?
You can request a quote for methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate?
Yes, CoreyChem provides custom synthesis services for methyl N-{[3-(acetylamino)phenyl]carbamoyl}-L-alaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.