methyl N-benzyl-N'-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]carbamimidothioate
Chemical Structure Depiction of
methyl N-benzyl-N'-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]carbamimidothioate
methyl N-benzyl-N'-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]carbamimidothioate
Compound characteristics
| Compound ID: | D019-1144 |
| Compound Name: | methyl N-benzyl-N'-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]carbamimidothioate |
| Molecular Weight: | 352.46 |
| Molecular Formula: | C19 H20 N4 O S |
| Smiles: | COc1cccc(c1)c1cc(/N=C(/NCc2ccccc2)SC)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 4.1058 |
| logD: | 1.9601 |
| logSw: | -4.376 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.449 |
| InChI Key: | SQADTKHENIAYAR-UHFFFAOYSA-N |