![methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate structure](/static/products/117/1173681-50-9.webp)
methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate
TL;DR: methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate (CAS 1173681-50-9) is a chemical compound with molecular formula C13H17FN2O3 and molecular weight 268.1223 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (2S)-2-[(4-fluorophenyl)carbamoylamino]-3-methylbutanoate
Also Known As: methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate, (S)-methyl 2-(3-(4-fluorophenyl)ureido)-3-methylbutanoate, methyl (2S)-2-[(4-fluorophenyl)carbamoylamino]-3-methylbutanoate
Technical Specifications
| Molecular Formula | C13H17FN2O3 |
| Molecular Weight | 268.1223 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 268.1223 Da |
| Heavy Atoms | 19 |
| Complexity | 315.0 |
| SMILES | CC(C)[C@@H](C(=O)OC)NC(=O)NC1=CC=C(C=C1)F |
| InChIKey | ZLRLJZMAMWHPCK-NSHDSACASA-N |
Chemical Property Profile of methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate
Property Insights of methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate. Following Lipinski's Rule of Five, methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate has 2 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-[(4-fluorophenyl)carbamoyl]-L-valinate?
The CAS number of methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate is 1173681-50-9.
What is the molecular formula of methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate?
The molecular formula of methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate is C13H17FN2O3.
What is the molecular weight of methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate?
The molecular weight of methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate is 268.1223 g/mol.
Where can I buy methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate?
You can request a quote for methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate?
Yes, CoreyChem provides custom synthesis services for methyl N-[(4-fluorophenyl)carbamoyl]-L-valinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.