[2-(tert-butylamino)-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl](1-ethyl-1H-pyrazol-5-yl)methanone
Chemical Structure Depiction of
[2-(tert-butylamino)-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl](1-ethyl-1H-pyrazol-5-yl)methanone
[2-(tert-butylamino)-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl](1-ethyl-1H-pyrazol-5-yl)methanone
Compound characteristics
| Compound ID: | S029-2178 |
| Compound Name: | [2-(tert-butylamino)-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl](1-ethyl-1H-pyrazol-5-yl)methanone |
| Molecular Weight: | 394.52 |
| Molecular Formula: | C22 H30 N6 O |
| Smiles: | CCn1c(ccn1)C(N1CCC2(C1)C(NC(C)(C)C)=Nc1ccccc1CN2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0816 |
| logD: | 2.0777 |
| logSw: | -2.6843 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.554 |
| InChI Key: | SBHBIOXLBPZHNI-QFIPXVFZSA-N |