1-[3-(3-fluorobenzene-1-sulfonyl)-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanamine--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-[3-(3-fluorobenzene-1-sulfonyl)-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanamine--hydrogen chloride (1/1)
1-[3-(3-fluorobenzene-1-sulfonyl)-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanamine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | H025-3069C |
| Compound Name: | 1-[3-(3-fluorobenzene-1-sulfonyl)-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanamine--hydrogen chloride (1/1) |
| Molecular Weight: | 416.92 |
| Molecular Formula: | C16 H17 F N4 O2 S2 |
| Salt: | HCl |
| Smiles: | Cc1c(CN)c(C)n2c(c(c(n2)SC)S(c2cccc(c2)F)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.266 |
| logD: | -0.2662 |
| logSw: | -2.2663 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.831 |
| InChI Key: | PSPPWWDGYLGFJH-UHFFFAOYSA-N |