1-acetyl-N-(2,4-dimethylphenyl)spiro[piperidine-4,4'-pyrrolo[1,2-a][1,4]benzodiazepine]-5'(6'H)-carboxamide
Chemical Structure Depiction of
1-acetyl-N-(2,4-dimethylphenyl)spiro[piperidine-4,4'-pyrrolo[1,2-a][1,4]benzodiazepine]-5'(6'H)-carboxamide
1-acetyl-N-(2,4-dimethylphenyl)spiro[piperidine-4,4'-pyrrolo[1,2-a][1,4]benzodiazepine]-5'(6'H)-carboxamide
Compound characteristics
| Compound ID: | C800-0804 |
| Compound Name: | 1-acetyl-N-(2,4-dimethylphenyl)spiro[piperidine-4,4'-pyrrolo[1,2-a][1,4]benzodiazepine]-5'(6'H)-carboxamide |
| Molecular Weight: | 442.56 |
| Molecular Formula: | C27 H30 N4 O2 |
| Smiles: | CC(N1CCC2(CC1)c1cccn1c1ccccc1CN2C(Nc1ccc(C)cc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2512 |
| logD: | 5.2512 |
| logSw: | -4.9803 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.048 |
| InChI Key: | AYTNBBQPLODXCV-UHFFFAOYSA-N |