[4-({[4-(2-methylphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
[4-({[4-(2-methylphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
[4-({[4-(2-methylphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V025-4490 |
| Compound Name: | [4-({[4-(2-methylphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 497.66 |
| Molecular Formula: | C29 H31 N5 O S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)c1nnc(n1c1ccccc1C)SCc1ccc(cc1)C(N1CCN(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6247 |
| logD: | 4.494 |
| logSw: | -4.3223 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.536 |
| InChI Key: | RNBDPKSYPOIQDY-UHFFFAOYSA-N |