2-benzyl-N-[(thiophen-3-yl)methyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
Chemical Structure Depiction of
2-benzyl-N-[(thiophen-3-yl)methyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
2-benzyl-N-[(thiophen-3-yl)methyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
Compound characteristics
| Compound ID: | S868-0157 |
| Compound Name: | 2-benzyl-N-[(thiophen-3-yl)methyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide |
| Molecular Weight: | 365.5 |
| Molecular Formula: | C21 H23 N3 O S |
| Smiles: | C1CN(Cc2ccccc2)Cc2ccc(C(NCc3ccsc3)=O)n2C1 |
| Stereo: | ACHIRAL |
| logP: | 3.4459 |
| logD: | 3.3996 |
| logSw: | -3.5662 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.2218 |
| InChI Key: | DUROBVPMEFFEND-UHFFFAOYSA-N |