3-[rel-(3R,4R)-3-(3-cyclohexyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidine-1-sulfonyl]pyridine
Chemical Structure Depiction of
3-[rel-(3R,4R)-3-(3-cyclohexyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidine-1-sulfonyl]pyridine
3-[rel-(3R,4R)-3-(3-cyclohexyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidine-1-sulfonyl]pyridine
Compound characteristics
| Compound ID: | SB34-1153 |
| Compound Name: | 3-[rel-(3R,4R)-3-(3-cyclohexyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidine-1-sulfonyl]pyridine |
| Molecular Weight: | 393.48 |
| Molecular Formula: | C18 H24 F N5 O2 S |
| Smiles: | C1CCC(CC1)c1nc([C@@H]2CN(C[C@H]2CF)S(c2cccnc2)(=O)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3198 |
| logD: | 2.3187 |
| logSw: | -2.4478 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.406 |
| InChI Key: | CBPIVNQFSPPDSQ-GDBMZVCRSA-N |