TL;DR: Glycopril (CAS 135038-56-1) is a chemical compound with molecular formula C22H23NO6S and molecular weight 429.1246 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl 2-[[(2S)-2-(acetylsulfanylmethyl)-3-(1,3-benzodioxol-5-yl)propanoyl]amino]acetate
Also Known As: Glycopril, (S)-N-(3-(3,4-Methylenedioxyphenyl)-2-(acetylthio)methyl-1-oxopropyl)glycine benzyl ester, benzyl 2-[[(2S)-2-(acetylsulfanylmethyl)-3-(1,3-benzodioxol-5-yl)propanoyl]amino]acetate, Glycine, N-(3-(acetylthio)-2-(1,3-benzodioxol-5-ylmethyl)-1-oxopropyl)-, phenylmethyl ester, (S)-, Benzyl N-[(2S)-2-[(acetylsulfanyl)methyl]-3-(2H-1,3-benzodioxol-5-yl)propanoyl]glycinate
| Molecular Formula | C22H23NO6S |
| Molecular Weight | 429.1246 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 429.1246 Da |
| Heavy Atoms | 30 |
| Complexity | 594.0 |
| SMILES | CC(=O)SC[C@@H](CC1=CC2=C(C=C1)OCO2)C(=O)NCC(=O)OCC3=CC=CC=C3 |
| InChIKey | IVBOFTGCTWVBLF-GOSISDBHSA-N |
The XLogP value of 3.1 indicates that Glycopril is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Glycopril. Following Lipinski's Rule of Five, Glycopril has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Glycopril is 135038-56-1.
The molecular formula of Glycopril is C22H23NO6S.
The molecular weight of Glycopril is 429.1246 g/mol.
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