[3-({[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
[3-({[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
[3-({[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V029-8259 |
| Compound Name: | [3-({[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 529.66 |
| Molecular Formula: | C29 H31 N5 O3 S |
| Salt: | not_available |
| Smiles: | CN1CCN(CC1)C(c1cccc(CSc2nnc(c3cccc(c3)OC)n2c2ccc(cc2)OC)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0929 |
| logD: | 3.9622 |
| logSw: | -4.3168 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.925 |
| InChI Key: | RJEMWGVLJMHLLY-UHFFFAOYSA-N |