4-(4-methoxyanilino)-7,7-dimethyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]-7,8-dihydroquinazolin-5(6H)-one
Chemical Structure Depiction of
4-(4-methoxyanilino)-7,7-dimethyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]-7,8-dihydroquinazolin-5(6H)-one
4-(4-methoxyanilino)-7,7-dimethyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]-7,8-dihydroquinazolin-5(6H)-one
Compound characteristics
| Compound ID: | Y020-3412 |
| Compound Name: | 4-(4-methoxyanilino)-7,7-dimethyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]-7,8-dihydroquinazolin-5(6H)-one |
| Molecular Weight: | 459.55 |
| Molecular Formula: | C25 H29 N7 O2 |
| Smiles: | CC1(C)CC(c2c(C1)nc(nc2Nc1ccc(cc1)OC)N1CCN(CC1)c1ncccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6367 |
| logD: | 4.6357 |
| logSw: | -4.5527 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.577 |
| InChI Key: | LNHHLYIUSPYMHR-UHFFFAOYSA-N |