1-(4-methoxyphenyl)-N-[rel-(3R,4S)-1-methyl-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]cyclopropane-1-carboxamide
Chemical Structure Depiction of
1-(4-methoxyphenyl)-N-[rel-(3R,4S)-1-methyl-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]cyclopropane-1-carboxamide
1-(4-methoxyphenyl)-N-[rel-(3R,4S)-1-methyl-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]cyclopropane-1-carboxamide
Compound characteristics
| Compound ID: | SB33-0974 |
| Compound Name: | 1-(4-methoxyphenyl)-N-[rel-(3R,4S)-1-methyl-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]cyclopropane-1-carboxamide |
| Molecular Weight: | 417.51 |
| Molecular Formula: | C24 H27 N5 O2 |
| Smiles: | CN1C[C@H]([C@@H](C1)c1nc(c2ccccc2)n[nH]1)NC(C1(CC1)c1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9224 |
| logD: | 0.6008 |
| logSw: | -3.3219 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.785 |
| InChI Key: | CEDUKPMWOSCSHC-PMACEKPBSA-N |