TL;DR: N-[(2,5-dichlorophenyl)carbamoyl]-D-alanine (CAS 1173676-40-8) is a chemical compound with molecular formula C10H10Cl2N2O3 and molecular weight 276.00684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-[(2,5-dichlorophenyl)carbamoylamino]propanoic acid
Also Known As: N-[(2,5-dichlorophenyl)carbamoyl]-D-alanine, (R)-2-(3-(2,5-dichlorophenyl)ureido)propanoic acid, 2-[(2,5-dichlorophenyl)carbamoylamino]propanoic Acid, (2R)-2-[(2,5-dichlorophenyl)carbamoylamino]propanoic acid
| Molecular Formula | C10H10Cl2N2O3 |
| Molecular Weight | 276.00684 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.00684 Da |
| Heavy Atoms | 17 |
| Complexity | 301.0 |
| SMILES | C[C@H](C(=O)O)NC(=O)NC1=C(C=CC(=C1)Cl)Cl |
| InChIKey | UOXHFJIIHIZSND-RXMQYKEDSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2,5-dichlorophenyl)carbamoyl]-D-alanine. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2,5-dichlorophenyl)carbamoyl]-D-alanine. Following Lipinski's Rule of Five, N-[(2,5-dichlorophenyl)carbamoyl]-D-alanine 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]-D-alanine is 1173676-40-8.
The molecular formula of N-[(2,5-dichlorophenyl)carbamoyl]-D-alanine is C10H10Cl2N2O3.
The molecular weight of N-[(2,5-dichlorophenyl)carbamoyl]-D-alanine is 276.00684 g/mol.
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