2-benzyl-N-{3-[(1-ethylpiperidin-4-yl)oxy]propyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
Chemical Structure Depiction of
2-benzyl-N-{3-[(1-ethylpiperidin-4-yl)oxy]propyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
2-benzyl-N-{3-[(1-ethylpiperidin-4-yl)oxy]propyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
Compound characteristics
| Compound ID: | S868-0110 |
| Compound Name: | 2-benzyl-N-{3-[(1-ethylpiperidin-4-yl)oxy]propyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide |
| Molecular Weight: | 438.61 |
| Molecular Formula: | C26 H38 N4 O2 |
| Smiles: | CCN1CCC(CC1)OCCCNC(c1ccc2CN(CCCn12)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.547 |
| logD: | 0.1447 |
| logSw: | -2.626 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.705 |
| InChI Key: | ZCWGRVDKFINLNQ-UHFFFAOYSA-N |