[4-({[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
[4-({[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
[4-({[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V014-9697 |
| Compound Name: | [4-({[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C22 H26 N6 O S |
| Salt: | not_available |
| Smiles: | CCn1c(c2ccncc2)nnc1SCc1ccc(cc1)C(N1CCN(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6351 |
| logD: | 1.5044 |
| logSw: | -1.8688 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.519 |
| InChI Key: | FUJLPXXJNJUBAI-UHFFFAOYSA-N |