(3-fluoro-4-methylphenyl){2-[(2-methoxyethyl)amino]-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl}methanone
Chemical Structure Depiction of
(3-fluoro-4-methylphenyl){2-[(2-methoxyethyl)amino]-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl}methanone
(3-fluoro-4-methylphenyl){2-[(2-methoxyethyl)amino]-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl}methanone
Compound characteristics
| Compound ID: | S029-0117 |
| Compound Name: | (3-fluoro-4-methylphenyl){2-[(2-methoxyethyl)amino]-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl}methanone |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C23 H27 F N4 O2 |
| Smiles: | Cc1ccc(cc1F)C(N1CCC2(C1)C(NCCOC)=Nc1ccccc1CN2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4702 |
| logD: | 2.4659 |
| logSw: | -2.8371 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.825 |
| InChI Key: | UPSUERNJXQLIKQ-QHCPKHFHSA-N |