N-cycloheptyl-5-[(4-ethylphenyl)methyl]-4-oxo-5,6-dihydro-4H-pyrrolo[1,2-a]thieno[2,3-f][1,4]diazepine-6-carboxamide
Chemical Structure Depiction of
N-cycloheptyl-5-[(4-ethylphenyl)methyl]-4-oxo-5,6-dihydro-4H-pyrrolo[1,2-a]thieno[2,3-f][1,4]diazepine-6-carboxamide
N-cycloheptyl-5-[(4-ethylphenyl)methyl]-4-oxo-5,6-dihydro-4H-pyrrolo[1,2-a]thieno[2,3-f][1,4]diazepine-6-carboxamide
Compound characteristics
| Compound ID: | C795-1217 |
| Compound Name: | N-cycloheptyl-5-[(4-ethylphenyl)methyl]-4-oxo-5,6-dihydro-4H-pyrrolo[1,2-a]thieno[2,3-f][1,4]diazepine-6-carboxamide |
| Molecular Weight: | 461.63 |
| Molecular Formula: | C27 H31 N3 O2 S |
| Smiles: | CCc1ccc(CN2C(C(NC3CCCCCC3)=O)c3cccn3c3ccsc3C2=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0923 |
| logD: | 6.0923 |
| logSw: | -5.3009 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.366 |
| InChI Key: | BBASUVNQCVAMDS-DEOSSOPVSA-N |