2-benzyl-N-[2-(1H-pyrazol-1-yl)ethyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
Chemical Structure Depiction of
2-benzyl-N-[2-(1H-pyrazol-1-yl)ethyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
2-benzyl-N-[2-(1H-pyrazol-1-yl)ethyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
Compound characteristics
| Compound ID: | S868-0112 |
| Compound Name: | 2-benzyl-N-[2-(1H-pyrazol-1-yl)ethyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide |
| Molecular Weight: | 363.46 |
| Molecular Formula: | C21 H25 N5 O |
| Smiles: | C1CN(Cc2ccccc2)Cc2ccc(C(NCCn3cccn3)=O)n2C1 |
| Stereo: | ACHIRAL |
| logP: | 1.8096 |
| logD: | 1.7633 |
| logSw: | -2.0862 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.818 |
| InChI Key: | LZTHBYSZNIJXRX-UHFFFAOYSA-N |