N-{[(4,6-dimethylpyrimidin-2-yl)amino](3-methylanilino)methylidene}-N'-phenylthiourea
Chemical Structure Depiction of
N-{[(4,6-dimethylpyrimidin-2-yl)amino](3-methylanilino)methylidene}-N'-phenylthiourea
N-{[(4,6-dimethylpyrimidin-2-yl)amino](3-methylanilino)methylidene}-N'-phenylthiourea
Compound characteristics
| Compound ID: | Y021-4653 |
| Compound Name: | N-{[(4,6-dimethylpyrimidin-2-yl)amino](3-methylanilino)methylidene}-N'-phenylthiourea |
| Molecular Weight: | 390.51 |
| Molecular Formula: | C21 H22 N6 S |
| Smiles: | Cc1cccc(c1)N/C(Nc1nc(C)cc(C)n1)=N/C(Nc1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.538 |
| logD: | -2.102 |
| logSw: | -4.334 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 55.58 |
| InChI Key: | SVQNZGUFAWYAOA-UHFFFAOYSA-N |