2-(3,4-dimethoxyphenyl)-5-(2,4-dimethylbenzene-1-sulfonyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-5-(2,4-dimethylbenzene-1-sulfonyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine
2-(3,4-dimethoxyphenyl)-5-(2,4-dimethylbenzene-1-sulfonyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine
Compound characteristics
| Compound ID: | T202-0014 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-5-(2,4-dimethylbenzene-1-sulfonyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C23 H27 N3 O4 S |
| Smiles: | Cc1ccc(c(C)c1)S(N1CCCn2c(C1)cc(c1ccc(c(c1)OC)OC)n2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7918 |
| logD: | 3.7918 |
| logSw: | -3.9099 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.741 |
| InChI Key: | VVZOAFODWPKDPA-UHFFFAOYSA-N |