3-(benzenesulfonyl)-7-methyl-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-(benzenesulfonyl)-7-methyl-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine--hydrogen chloride (1/1)
3-(benzenesulfonyl)-7-methyl-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | H025-3027C |
| Compound Name: | 3-(benzenesulfonyl)-7-methyl-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine--hydrogen chloride (1/1) |
| Molecular Weight: | 410.94 |
| Molecular Formula: | C17 H18 N4 O2 S2 |
| Salt: | HCl |
| Smiles: | CN1CCC2C(C1)=Cn1c(c(c(n1)SC)S(c1ccccc1)(=O)=O)N=2 |
| Stereo: | ACHIRAL |
| logP: | 1.275 |
| logD: | 1.248 |
| logSw: | -2.3054 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.627 |
| InChI Key: | XYJSJXVLOQQHSH-UHFFFAOYSA-N |