4-[1-(2-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazinylidene)ethyl]phenyl acetate
Chemical Structure Depiction of
4-[1-(2-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazinylidene)ethyl]phenyl acetate
4-[1-(2-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazinylidene)ethyl]phenyl acetate
Compound characteristics
| Compound ID: | 3254-1972 |
| Compound Name: | 4-[1-(2-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazinylidene)ethyl]phenyl acetate |
| Molecular Weight: | 437.52 |
| Molecular Formula: | C22 H23 N5 O3 S |
| Smiles: | CCn1c(c2ccccc2)nnc1SCC(N/N=C(\C)c1ccc(cc1)OC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3777 |
| logD: | 3.3773 |
| logSw: | -3.5977 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.378 |
| InChI Key: | UNIHCAMKJIJXEJ-UHFFFAOYSA-N |