(morpholin-4-yl)[2-({[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Chemical Structure Depiction of
(morpholin-4-yl)[2-({[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
(morpholin-4-yl)[2-({[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Compound characteristics
| Compound ID: | V029-8029 |
| Compound Name: | (morpholin-4-yl)[2-({[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone |
| Molecular Weight: | 426.56 |
| Molecular Formula: | C21 H22 N4 O2 S2 |
| Salt: | not_available |
| Smiles: | C=CCn1c(c2cccs2)nnc1SCc1ccccc1C(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4748 |
| logD: | 3.4748 |
| logSw: | -3.5716 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.794 |
| InChI Key: | KOYNUNZYTIADCE-UHFFFAOYSA-N |