methyl N-(3-chloro-4-methoxyphenyl)-N'-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]carbamimidothioate
Chemical Structure Depiction of
methyl N-(3-chloro-4-methoxyphenyl)-N'-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]carbamimidothioate
methyl N-(3-chloro-4-methoxyphenyl)-N'-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]carbamimidothioate
Compound characteristics
| Compound ID: | D019-1154 |
| Compound Name: | methyl N-(3-chloro-4-methoxyphenyl)-N'-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]carbamimidothioate |
| Molecular Weight: | 402.9 |
| Molecular Formula: | C19 H19 Cl N4 O2 S |
| Smiles: | COc1cccc(c1)c1cc(/N=C(/Nc2ccc(c(c2)[Cl])OC)SC)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 5.1165 |
| logD: | 4.5927 |
| logSw: | -5.8584 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.758 |
| InChI Key: | UYVJHRSWKIAQMR-UHFFFAOYSA-N |