2-(3,4-dimethoxyphenyl)-5-(phenylmethanesulfonyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-5-(phenylmethanesulfonyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine
2-(3,4-dimethoxyphenyl)-5-(phenylmethanesulfonyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine
Compound characteristics
| Compound ID: | T202-0006 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-5-(phenylmethanesulfonyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C22 H25 N3 O4 S |
| Smiles: | COc1ccc(cc1OC)c1cc2CN(CCCn2n1)S(Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5661 |
| logD: | 2.5661 |
| logSw: | -2.8315 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.635 |
| InChI Key: | LVWKXPODFYLGIU-UHFFFAOYSA-N |