N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-(4-{[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)urea
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-(4-{[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)urea
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-(4-{[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)urea
Compound characteristics
| Compound ID: | D430-2348 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-(4-{[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)urea |
| Molecular Weight: | 482.54 |
| Molecular Formula: | C27 H26 N6 O3 |
| Smiles: | Cc1ccc(cc1)Nc1cc(Nc2ccc(cc2)NC(Nc2ccc3c(c2)OCCO3)=O)nc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2888 |
| logD: | 4.5091 |
| logSw: | -5.2706 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 85.508 |
| InChI Key: | QGPGXIKBRDBVHC-UHFFFAOYSA-N |