TL;DR: N-[(4-butylphenyl)carbamoyl]-D-phenylalanine (CAS 1173680-52-8) is a chemical compound with molecular formula C20H24N2O3 and molecular weight 340.17868 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-[(4-butylphenyl)carbamoylamino]-3-phenylpropanoic acid
Also Known As: N-[(4-butylphenyl)carbamoyl]-D-phenylalanine, (R)-2-(3-(4-butylphenyl)ureido)-3-phenylpropanoic acid, 2-[(4-butylphenyl)carbamoylamino]-3-phenyl-propanoic Acid, (2R)-2-[(4-butylphenyl)carbamoylamino]-3-phenylpropanoic acid
| Molecular Formula | C20H24N2O3 |
| Molecular Weight | 340.17868 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 340.17868 Da |
| Heavy Atoms | 25 |
| Complexity | 413.0 |
| SMILES | CCCCC1=CC=C(C=C1)NC(=O)N[C@H](CC2=CC=CC=C2)C(=O)O |
| InChIKey | KUHOAQVGJQNXEB-GOSISDBHSA-N |
The XLogP value of 4.4 indicates that N-[(4-butylphenyl)carbamoyl]-D-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-[(4-butylphenyl)carbamoyl]-D-phenylalanine. Following Lipinski's Rule of Five, N-[(4-butylphenyl)carbamoyl]-D-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-[(4-butylphenyl)carbamoyl]-D-phenylalanine is 1173680-52-8.
The molecular formula of N-[(4-butylphenyl)carbamoyl]-D-phenylalanine is C20H24N2O3.
The molecular weight of N-[(4-butylphenyl)carbamoyl]-D-phenylalanine is 340.17868 g/mol.
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