methyl 4-[(2-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]benzoate
Chemical Structure Depiction of
methyl 4-[(2-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]benzoate
methyl 4-[(2-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]benzoate
Compound characteristics
| Compound ID: | 4694-0295 |
| Compound Name: | methyl 4-[(2-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]benzoate |
| Molecular Weight: | 358.42 |
| Molecular Formula: | C17 H18 N4 O3 S |
| Smiles: | Cc1cc(C)nc(n1)SCC(N/N=C/c1ccc(cc1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5053 |
| logD: | 2.505 |
| logSw: | -2.7513 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.421 |
| InChI Key: | KECLIFUTKJJINQ-UHFFFAOYSA-N |