TL;DR: N-[(3-acetylphenyl)carbamoyl]-L-valine (CAS 1173684-02-0) is a chemical compound with molecular formula C14H18N2O4 and molecular weight 278.12665 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[(3-acetylphenyl)carbamoylamino]-3-methylbutanoic acid
Also Known As: N-[(3-acetylphenyl)carbamoyl]-L-valine, (S)-2-(3-(3-acetylphenyl)ureido)-3-methylbutanoic acid, 2-[(3-acetylphenyl)carbamoylamino]-3-methyl-butanoic Acid, (2S)-2-[(3-acetylphenyl)carbamoylamino]-3-methylbutanoic acid
| Molecular Formula | C14H18N2O4 |
| Molecular Weight | 278.12665 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 278.12665 Da |
| Heavy Atoms | 20 |
| Complexity | 381.0 |
| SMILES | CC(C)[C@@H](C(=O)O)NC(=O)NC1=CC=CC(=C1)C(=O)C |
| InChIKey | FANLHVKFEXRUSN-LBPRGKRZSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3-acetylphenyl)carbamoyl]-L-valine. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3-acetylphenyl)carbamoyl]-L-valine. Following Lipinski's Rule of Five, N-[(3-acetylphenyl)carbamoyl]-L-valine has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[(3-acetylphenyl)carbamoyl]-L-valine is 1173684-02-0.
The molecular formula of N-[(3-acetylphenyl)carbamoyl]-L-valine is C14H18N2O4.
The molecular weight of N-[(3-acetylphenyl)carbamoyl]-L-valine is 278.12665 g/mol.
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