4-anilino-7,7-dimethyl-2-(4-methylpiperazin-1-yl)-7,8-dihydroquinazolin-5(6H)-one
Chemical Structure Depiction of
4-anilino-7,7-dimethyl-2-(4-methylpiperazin-1-yl)-7,8-dihydroquinazolin-5(6H)-one
4-anilino-7,7-dimethyl-2-(4-methylpiperazin-1-yl)-7,8-dihydroquinazolin-5(6H)-one
Compound characteristics
| Compound ID: | Y020-3400 |
| Compound Name: | 4-anilino-7,7-dimethyl-2-(4-methylpiperazin-1-yl)-7,8-dihydroquinazolin-5(6H)-one |
| Molecular Weight: | 365.48 |
| Molecular Formula: | C21 H27 N5 O |
| Smiles: | CC1(C)CC(c2c(C1)nc(nc2Nc1ccccc1)N1CCN(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4807 |
| logD: | 2.9088 |
| logSw: | -3.8614 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.887 |
| InChI Key: | GCDQRFWBWRMCGM-UHFFFAOYSA-N |