(2-benzyl-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepin-7-yl)(4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
(2-benzyl-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepin-7-yl)(4-methylpiperazin-1-yl)methanone
(2-benzyl-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepin-7-yl)(4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | S868-0163 |
| Compound Name: | (2-benzyl-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepin-7-yl)(4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 352.48 |
| Molecular Formula: | C21 H28 N4 O |
| Smiles: | CN1CCN(CC1)C(c1ccc2CN(CCCn12)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9532 |
| logD: | 1.8221 |
| logSw: | -2.0853 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.915 |
| InChI Key: | YUNZSTDBNYEUHE-UHFFFAOYSA-N |