N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-(4-{[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino}phenyl)urea
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-(4-{[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino}phenyl)urea
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-(4-{[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino}phenyl)urea
Compound characteristics
| Compound ID: | D430-2320 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-(4-{[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino}phenyl)urea |
| Molecular Weight: | 420.47 |
| Molecular Formula: | C22 H24 N6 O3 |
| Smiles: | Cc1nc(cc(n1)N(C)C)Nc1ccc(cc1)NC(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5724 |
| logD: | 2.3155 |
| logSw: | -3.7381 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.296 |
| InChI Key: | CQNRATYWCRKPQB-UHFFFAOYSA-N |