[rel-(3R,4R)-3-(methoxymethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](2-methylpyridin-4-yl)methanone
Chemical Structure Depiction of
[rel-(3R,4R)-3-(methoxymethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](2-methylpyridin-4-yl)methanone
[rel-(3R,4R)-3-(methoxymethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](2-methylpyridin-4-yl)methanone
Compound characteristics
| Compound ID: | SB32-0910 |
| Compound Name: | [rel-(3R,4R)-3-(methoxymethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](2-methylpyridin-4-yl)methanone |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C21 H23 N5 O2 |
| Smiles: | Cc1cc(ccn1)C(N1C[C@@H](COC)[C@@H](C1)c1nc(c2ccccc2)n[nH]1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1352 |
| logD: | 2.1194 |
| logSw: | -2.7724 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.911 |
| InChI Key: | VKADEUWUFXRYOZ-ZWKOTPCHSA-N |