N-[(2,4-dimethoxyphenyl)methyl]-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[(2,4-dimethoxyphenyl)methyl]-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
N-[(2,4-dimethoxyphenyl)methyl]-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0637 |
| Compound Name: | N-[(2,4-dimethoxyphenyl)methyl]-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C21 H21 N3 O3 S |
| Smiles: | COc1ccc(CNC(c2cnc(nc2c2ccccc2)SC)=O)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.0818 |
| logD: | 4.0818 |
| logSw: | -4.2835 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.14 |
| InChI Key: | NONAFKNCBFVULI-UHFFFAOYSA-N |