4-anilino-7,7-dimethyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]-7,8-dihydroquinazolin-5(6H)-one
Chemical Structure Depiction of
4-anilino-7,7-dimethyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]-7,8-dihydroquinazolin-5(6H)-one
4-anilino-7,7-dimethyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]-7,8-dihydroquinazolin-5(6H)-one
Compound characteristics
| Compound ID: | Y020-3404 |
| Compound Name: | 4-anilino-7,7-dimethyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]-7,8-dihydroquinazolin-5(6H)-one |
| Molecular Weight: | 429.52 |
| Molecular Formula: | C24 H27 N7 O |
| Smiles: | CC1(C)CC(c2c(C1)nc(nc2Nc1ccccc1)N1CCN(CC1)c1ncccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4626 |
| logD: | 4.4616 |
| logSw: | -4.4147 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.033 |
| InChI Key: | OZFWSTQGYOOVFC-UHFFFAOYSA-N |