(4-chloro-1-ethyl-1H-pyrazol-3-yl)[2-(cyclopentylamino)-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl]methanone
Chemical Structure Depiction of
(4-chloro-1-ethyl-1H-pyrazol-3-yl)[2-(cyclopentylamino)-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl]methanone
(4-chloro-1-ethyl-1H-pyrazol-3-yl)[2-(cyclopentylamino)-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl]methanone
Compound characteristics
| Compound ID: | S029-0928 |
| Compound Name: | (4-chloro-1-ethyl-1H-pyrazol-3-yl)[2-(cyclopentylamino)-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl]methanone |
| Molecular Weight: | 440.98 |
| Molecular Formula: | C23 H29 Cl N6 O |
| Smiles: | CCn1cc(c(C(N2CCC3(C2)C(NC2CCCC2)=Nc2ccccc2CN3)=O)n1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8099 |
| logD: | 2.6862 |
| logSw: | -3.4756 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.509 |
| InChI Key: | ZYAHUUYPCUSXDG-QHCPKHFHSA-N |