5-{rel-(3R,4R)-4-(methoxymethyl)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-3-yl}-3-methyl-1H-1,2,4-triazole
Chemical Structure Depiction of
5-{rel-(3R,4R)-4-(methoxymethyl)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-3-yl}-3-methyl-1H-1,2,4-triazole
5-{rel-(3R,4R)-4-(methoxymethyl)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-3-yl}-3-methyl-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | SB32-0155 |
| Compound Name: | 5-{rel-(3R,4R)-4-(methoxymethyl)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-3-yl}-3-methyl-1H-1,2,4-triazole |
| Molecular Weight: | 307.42 |
| Molecular Formula: | C14 H21 N5 O S |
| Smiles: | Cc1c(CN2C[C@@H](COC)[C@@H](C2)c2nc(C)n[nH]2)scn1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9832 |
| logD: | -1.5332 |
| logSw: | -2.3067 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.23 |
| InChI Key: | CNHIIQSTOSYPNQ-NWDGAFQWSA-N |