(4-ethylpiperazin-1-yl)[4-({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Chemical Structure Depiction of
(4-ethylpiperazin-1-yl)[4-({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
(4-ethylpiperazin-1-yl)[4-({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Compound characteristics
| Compound ID: | V026-6364 |
| Compound Name: | (4-ethylpiperazin-1-yl)[4-({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone |
| Molecular Weight: | 437.56 |
| Molecular Formula: | C23 H27 N5 O2 S |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)C(c1ccc(CSc2nnc(c3ccco3)n2CC=C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3901 |
| logD: | 2.2139 |
| logSw: | -2.3147 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.983 |
| InChI Key: | OGHCGWZFBCQUGC-UHFFFAOYSA-N |