3-{[rel-(3R,4R)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]methyl}-5-methoxy-1-methyl-1H-indole
Chemical Structure Depiction of
3-{[rel-(3R,4R)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]methyl}-5-methoxy-1-methyl-1H-indole
3-{[rel-(3R,4R)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]methyl}-5-methoxy-1-methyl-1H-indole
Compound characteristics
| Compound ID: | SB34-0040 |
| Compound Name: | 3-{[rel-(3R,4R)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]methyl}-5-methoxy-1-methyl-1H-indole |
| Molecular Weight: | 357.43 |
| Molecular Formula: | C19 H24 F N5 O |
| Smiles: | Cc1nc([C@@H]2CN(Cc3cn(C)c4ccc(cc34)OC)C[C@H]2CF)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.9297 |
| logD: | -2.4509 |
| logSw: | -2.5527 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.705 |
| InChI Key: | YDTVIHCMKGJRMA-GUYCJALGSA-N |