1-[3-(benzenesulfonyl)-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]-N,N-dimethylmethanamine--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-[3-(benzenesulfonyl)-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]-N,N-dimethylmethanamine--hydrogen chloride (1/1)
1-[3-(benzenesulfonyl)-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]-N,N-dimethylmethanamine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | H025-3064C |
| Compound Name: | 1-[3-(benzenesulfonyl)-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]-N,N-dimethylmethanamine--hydrogen chloride (1/1) |
| Molecular Weight: | 426.99 |
| Molecular Formula: | C18 H22 N4 O2 S2 |
| Salt: | HCl |
| Smiles: | Cc1c(CN(C)C)c(C)n2c(c(c(n2)SC)S(c2ccccc2)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.1394 |
| logD: | 1.0797 |
| logSw: | -2.5364 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.058 |
| InChI Key: | AHEXCLYXKSEHIQ-UHFFFAOYSA-N |