5-benzyl-N-[2-(5-chloro-1H-indol-3-yl)ethyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
5-benzyl-N-[2-(5-chloro-1H-indol-3-yl)ethyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
5-benzyl-N-[2-(5-chloro-1H-indol-3-yl)ethyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | G542-0229 |
| Compound Name: | 5-benzyl-N-[2-(5-chloro-1H-indol-3-yl)ethyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 461.95 |
| Molecular Formula: | C25 H24 Cl N5 O2 |
| Smiles: | C1CN(Cc2ccccc2)C(c2cc(C(NCCc3c[nH]c4ccc(cc34)[Cl])=O)nn2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4484 |
| logD: | 3.4484 |
| logSw: | -3.9156 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.507 |
| InChI Key: | POQHTZFIFAAUDT-UHFFFAOYSA-N |