(4-ethylpiperazin-1-yl)[2-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepin-7-yl]methanone
Chemical Structure Depiction of
(4-ethylpiperazin-1-yl)[2-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepin-7-yl]methanone
(4-ethylpiperazin-1-yl)[2-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepin-7-yl]methanone
Compound characteristics
| Compound ID: | S868-0384 |
| Compound Name: | (4-ethylpiperazin-1-yl)[2-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepin-7-yl]methanone |
| Molecular Weight: | 354.47 |
| Molecular Formula: | C16 H26 N4 O3 S |
| Smiles: | CCN1CCN(CC1)C(c1ccc2CN(CCCn12)S(C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2952 |
| logD: | 0.1185 |
| logSw: | -2.0402 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.717 |
| InChI Key: | AHSXRAQIVIOPOL-UHFFFAOYSA-N |