4-[rel-(3R,4R)-3-(3-cyclohexyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidine-1-sulfonyl]morpholine
Chemical Structure Depiction of
4-[rel-(3R,4R)-3-(3-cyclohexyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidine-1-sulfonyl]morpholine
4-[rel-(3R,4R)-3-(3-cyclohexyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidine-1-sulfonyl]morpholine
Compound characteristics
| Compound ID: | SB34-1206 |
| Compound Name: | 4-[rel-(3R,4R)-3-(3-cyclohexyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidine-1-sulfonyl]morpholine |
| Molecular Weight: | 401.5 |
| Molecular Formula: | C17 H28 F N5 O3 S |
| Smiles: | C1CCC(CC1)c1nc([C@@H]2CN(C[C@H]2CF)S(N2CCOCC2)(=O)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4869 |
| logD: | 1.4856 |
| logSw: | -2.3308 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.202 |
| InChI Key: | ZBFDURZNZILVNW-HUUCEWRRSA-N |