[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl](thiophen-2-yl)methanone
Chemical Structure Depiction of
[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl](thiophen-2-yl)methanone
[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl](thiophen-2-yl)methanone
Compound characteristics
Compound ID: | SB29-0270 |
Compound Name: | [(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl](thiophen-2-yl)methanone |
Molecular Weight: | 368.46 |
Molecular Formula: | C19 H20 N4 O2 S |
Smiles: | Cc1nc([C@@H]2C[C@@H](CN2C(c2cccs2)=O)OCc2ccccc2)n[nH]1 |
Stereo: | ABSOLUTE |
logP: | 2.8796 |
logD: | 2.8782 |
logSw: | -3.1681 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.038 |
InChI Key: | RDAHHVCSDVLETP-CVEARBPZSA-N |