TL;DR: Phosphonic acid, [amino(4-chlorophenyl)methyl]-, diethyl ester, (S)- (CAS 110480-88-1) is a chemical compound with molecular formula C11H17ClNO3P and molecular weight 277.06345 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(S)-(4-chlorophenyl)-diethoxyphosphorylmethanamine
Also Known As: (4-chlorophenyl)-diethoxyphosphoryl-methanamine, (S)-(4-chlorophenyl)-diethoxyphosphorylmethanamine, Diethyl [(S)-amino(4-chlorophenyl)methyl]phosphonate, Phosphonic acid, [amino(4-chlorophenyl)methyl]-, diethyl ester, (S)-
| Molecular Formula | C11H17ClNO3P |
| Molecular Weight | 277.06345 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 277.06345 Da |
| Heavy Atoms | 17 |
| Complexity | 259.0 |
| SMILES | CCOP(=O)([C@@H](C1=CC=C(C=C1)Cl)N)OCC |
| InChIKey | CLTNPSYRMWSMNP-NSHDSACASA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonic acid, [amino(4-chlorophenyl)methyl]-, diethyl ester, (S)-. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphonic acid, [amino(4-chlorophenyl)methyl]-, diethyl ester, (S)-. Following Lipinski's Rule of Five, Phosphonic acid, [amino(4-chlorophenyl)methyl]-, diethyl ester, (S)- has 1 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 Phosphonic acid, [amino(4-chlorophenyl)methyl]-, diethyl ester, (S)- is 110480-88-1.
The molecular formula of Phosphonic acid, [amino(4-chlorophenyl)methyl]-, diethyl ester, (S)- is C11H17ClNO3P.
The molecular weight of Phosphonic acid, [amino(4-chlorophenyl)methyl]-, diethyl ester, (S)- is 277.06345 g/mol.
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