N-(4-{[6-(cyclohexylamino)-2-methylpyrimidin-4-yl]amino}phenyl)-N'-[3-(methylsulfanyl)phenyl]urea
Chemical Structure Depiction of
N-(4-{[6-(cyclohexylamino)-2-methylpyrimidin-4-yl]amino}phenyl)-N'-[3-(methylsulfanyl)phenyl]urea
N-(4-{[6-(cyclohexylamino)-2-methylpyrimidin-4-yl]amino}phenyl)-N'-[3-(methylsulfanyl)phenyl]urea
Compound characteristics
| Compound ID: | D638-0105 |
| Compound Name: | N-(4-{[6-(cyclohexylamino)-2-methylpyrimidin-4-yl]amino}phenyl)-N'-[3-(methylsulfanyl)phenyl]urea |
| Molecular Weight: | 462.62 |
| Molecular Formula: | C25 H30 N6 O S |
| Smiles: | Cc1nc(cc(Nc2ccc(cc2)NC(Nc2cccc(c2)SC)=O)n1)NC1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 6.4465 |
| logD: | 6.2438 |
| logSw: | -5.4947 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 70.732 |
| InChI Key: | COQYPFZTWAPHIS-UHFFFAOYSA-N |