1-benzyl-6-hydroxy-4-(1-methyl-1H-pyrrole-2-carbonyl)-1,4-diazepan-2-one
Chemical Structure Depiction of
1-benzyl-6-hydroxy-4-(1-methyl-1H-pyrrole-2-carbonyl)-1,4-diazepan-2-one
1-benzyl-6-hydroxy-4-(1-methyl-1H-pyrrole-2-carbonyl)-1,4-diazepan-2-one
Compound characteristics
| Compound ID: | SA85-0631 |
| Compound Name: | 1-benzyl-6-hydroxy-4-(1-methyl-1H-pyrrole-2-carbonyl)-1,4-diazepan-2-one |
| Molecular Weight: | 327.38 |
| Molecular Formula: | C18 H21 N3 O3 |
| Smiles: | Cn1cccc1C(N1CC(CN(Cc2ccccc2)C(C1)=O)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2308 |
| logD: | 1.2308 |
| logSw: | -1.5381 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.861 |
| InChI Key: | KLPDXOAQOPKTJQ-OAHLLOKOSA-N |