[2-({[4-ethyl-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-ethylpiperazin-1-yl)methanone
Chemical Structure Depiction of
[2-({[4-ethyl-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-ethylpiperazin-1-yl)methanone
[2-({[4-ethyl-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-ethylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V025-9292 |
| Compound Name: | [2-({[4-ethyl-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-ethylpiperazin-1-yl)methanone |
| Molecular Weight: | 403.55 |
| Molecular Formula: | C20 H29 N5 O2 S |
| Smiles: | CCN1CCN(CC1)C(c1ccccc1CSc1nnc(COC)n1CC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6357 |
| logD: | 1.4595 |
| logSw: | -2.419 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.822 |
| InChI Key: | WVKFVQSGPHAOBF-UHFFFAOYSA-N |