N-(4-{[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(4-{[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)thiophene-2-carboxamide
N-(4-{[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | D430-0520 |
| Compound Name: | N-(4-{[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)thiophene-2-carboxamide |
| Molecular Weight: | 415.52 |
| Molecular Formula: | C23 H21 N5 O S |
| Smiles: | Cc1ccc(cc1)Nc1cc(Nc2ccc(cc2)NC(c2cccs2)=O)nc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.5782 |
| logD: | 4.7986 |
| logSw: | -5.3695 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 61.491 |
| InChI Key: | VCFLEAVPLXUIKZ-UHFFFAOYSA-N |