4-(3,4-dimethoxyphenyl)pyrimidine-2(1H)-thione
Chemical Structure Depiction of
4-(3,4-dimethoxyphenyl)pyrimidine-2(1H)-thione
4-(3,4-dimethoxyphenyl)pyrimidine-2(1H)-thione
Compound characteristics
| Compound ID: | Y040-9546 |
| Compound Name: | 4-(3,4-dimethoxyphenyl)pyrimidine-2(1H)-thione |
| Molecular Weight: | 248.3 |
| Molecular Formula: | C12 H12 N2 O2 S |
| Smiles: | COc1ccc(cc1OC)C1C=CNC(N=1)=S |
| Stereo: | ACHIRAL |
| logP: | 1.3659 |
| logD: | 1.0619 |
| logSw: | -2.1684 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.098 |
| InChI Key: | PVKFJIMDQZULSV-UHFFFAOYSA-N |