cilazapril
(4S,7S)-7-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid
| Molecular Formula | C22H31N3O5 |
|---|---|
| Molecular Weight | 417.5 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 99.2 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 417.22638 |
| Heavy Atoms | 30 |
| Complexity | 608.0 |
Chemical Identifiers
| CAS Number | 88768-40-5 |
|---|---|
| SMILES | CCOC(=O)C(CCC1=CC=CC=C1)NC2CCCN3CCCC(N3C2=O)C(=O)O |
| InChIKey | HHHKFGXWKKUNCY-FHWLQOOXSA-N |
📖 Product Overview
cilazapril (CAS: 88768-40-5) is a chemical compound with molecular formula C22H31N3O5 and molecular weight 417.5 g/mol. Its IUPAC systematic name is (4S,7S)-7-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]-6-oxo-1,2,3,4,7,8,9,10-octahydropyridazino[1,2-a]diazepine-4-carboxylic acid.
HHHKFGXWKKUNCY-FHWLQOOXSA-N.
SMILES: CCOC(=O)C(CCC1=CC=CC=C1)NC2CCCN3CCCC(N3C2=O)C(=O)O.
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