1-butoxy-4-[4-(prop-2-en-1-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]butan-2-ol
Chemical Structure Depiction of
1-butoxy-4-[4-(prop-2-en-1-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]butan-2-ol
1-butoxy-4-[4-(prop-2-en-1-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]butan-2-ol
Compound characteristics
Compound ID: | 8005-2867 |
Compound Name: | 1-butoxy-4-[4-(prop-2-en-1-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]butan-2-ol |
Molecular Weight: | 285.41 |
Molecular Formula: | C13 H23 N3 O2 S |
Smiles: | CCCCOCC(CCc1nnc(n1CC=C)S)O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.4784 |
logD: | 1.054 |
logSw: | -1.1895 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 49.185 |
InChI Key: | JYRSKCRTDGATLV-NSHDSACASA-N |