(4-ethylpiperazin-1-yl)[3-({[5-(furan-2-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Chemical Structure Depiction of
(4-ethylpiperazin-1-yl)[3-({[5-(furan-2-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
(4-ethylpiperazin-1-yl)[3-({[5-(furan-2-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Compound characteristics
| Compound ID: | V030-1394 |
| Compound Name: | (4-ethylpiperazin-1-yl)[3-({[5-(furan-2-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone |
| Molecular Weight: | 503.62 |
| Molecular Formula: | C27 H29 N5 O3 S |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)C(c1cccc(CSc2nnc(c3ccco3)n2c2ccc(cc2)OC)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3267 |
| logD: | 3.1505 |
| logSw: | -3.5696 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.02 |
| InChI Key: | JGKHFJTYFJOBGS-UHFFFAOYSA-N |