5-benzyl-N-(2-chloro-4,6-dimethoxyphenyl)-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-chloro-4,6-dimethoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
5-benzyl-N-(2-chloro-4,6-dimethoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | G542-0222 |
| Compound Name: | 5-benzyl-N-(2-chloro-4,6-dimethoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 454.91 |
| Molecular Formula: | C23 H23 Cl N4 O4 |
| Smiles: | COc1cc(c(c(c1)[Cl])NC(c1cc2C(N(CCCn2n1)Cc1ccccc1)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.5814 |
| logD: | 2.234 |
| logSw: | -3.3707 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.251 |
| InChI Key: | GUPGWGHHIQTUQH-UHFFFAOYSA-N |