TL;DR: N-[(2,5-dichlorophenyl)carbamoyl]-L-phenylalanine (CAS 1173668-83-1) is a chemical compound with molecular formula C16H14Cl2N2O3 and molecular weight 352.03815 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[(2,5-dichlorophenyl)carbamoylamino]-3-phenylpropanoic acid
Also Known As: N-[(2,5-dichlorophenyl)carbamoyl]-L-phenylalanine, (S)-2-(3-(2,5-dichlorophenyl)ureido)-3-phenylpropanoic acid, 2-[(2,5-dichlorophenyl)carbamoylamino]-3-phenyl-propanoic Acid, (2S)-2-[(2,5-dichlorophenyl)carbamoylamino]-3-phenylpropanoic acid
| Molecular Formula | C16H14Cl2N2O3 |
| Molecular Weight | 352.03815 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 352.03815 Da |
| Heavy Atoms | 23 |
| Complexity | 416.0 |
| SMILES | C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)NC2=C(C=CC(=C2)Cl)Cl |
| InChIKey | RNNAXILOIQDCFJ-AWEZNQCLSA-N |
The XLogP value of 3.8 indicates that N-[(2,5-dichlorophenyl)carbamoyl]-L-phenylalanine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2,5-dichlorophenyl)carbamoyl]-L-phenylalanine. Following Lipinski's Rule of Five, N-[(2,5-dichlorophenyl)carbamoyl]-L-phenylalanine has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[(2,5-dichlorophenyl)carbamoyl]-L-phenylalanine is 1173668-83-1.
The molecular formula of N-[(2,5-dichlorophenyl)carbamoyl]-L-phenylalanine is C16H14Cl2N2O3.
The molecular weight of N-[(2,5-dichlorophenyl)carbamoyl]-L-phenylalanine is 352.03815 g/mol.
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