rel-(3R,4R)-N-cyclohexyl-3-(3-cyclohexyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidine-1-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-N-cyclohexyl-3-(3-cyclohexyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidine-1-carboxamide
rel-(3R,4R)-N-cyclohexyl-3-(3-cyclohexyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | SB34-1139 |
| Compound Name: | rel-(3R,4R)-N-cyclohexyl-3-(3-cyclohexyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidine-1-carboxamide |
| Molecular Weight: | 377.5 |
| Molecular Formula: | C20 H32 F N5 O |
| Smiles: | C1CCC(CC1)c1nc([C@@H]2CN(C[C@H]2CF)C(NC2CCCCC2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.9479 |
| logD: | 3.9463 |
| logSw: | -3.9097 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.693 |
| InChI Key: | AKJNMEKENLWARV-RDJZCZTQSA-N |