3-(benzenesulfonyl)-7-methyl-2-(piperazin-1-yl)-6,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-e]pyrimidine--hydrogen chloride (1/2)
Chemical Structure Depiction of
3-(benzenesulfonyl)-7-methyl-2-(piperazin-1-yl)-6,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-e]pyrimidine--hydrogen chloride (1/2)
3-(benzenesulfonyl)-7-methyl-2-(piperazin-1-yl)-6,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-e]pyrimidine--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | H025-0630C |
| Compound Name: | 3-(benzenesulfonyl)-7-methyl-2-(piperazin-1-yl)-6,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-e]pyrimidine--hydrogen chloride (1/2) |
| Molecular Weight: | 485.43 |
| Molecular Formula: | C20 H24 N6 O2 S |
| Salt: | 2HCl |
| Smiles: | CN1CCC2=C(C1)C=Nc1c(c(nn12)N1CCNCC1)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6338 |
| logD: | -0.4081 |
| logSw: | -2.3551 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.434 |
| InChI Key: | CITGOJAOWKPINJ-UHFFFAOYSA-N |