methyl N'-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)carbamimidothioate
Chemical Structure Depiction of
methyl N'-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)carbamimidothioate
methyl N'-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)carbamimidothioate
Compound characteristics
| Compound ID: | D019-1039 |
| Compound Name: | methyl N'-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-N-(2-methylphenyl)carbamimidothioate |
| Molecular Weight: | 382.48 |
| Molecular Formula: | C20 H22 N4 O2 S |
| Smiles: | Cc1ccccc1N/C(=N/c1cc(c2ccc(c(c2)OC)OC)n[nH]1)SC |
| Stereo: | ACHIRAL |
| logP: | 4.2512 |
| logD: | 3.4557 |
| logSw: | -4.3633 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.146 |
| InChI Key: | UYRCSBVJVKNAJQ-UHFFFAOYSA-N |