2-[(1,3-benzoxazol-2-yl)amino]-4-(4-fluorophenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Chemical Structure Depiction of
2-[(1,3-benzoxazol-2-yl)amino]-4-(4-fluorophenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one
2-[(1,3-benzoxazol-2-yl)amino]-4-(4-fluorophenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Compound characteristics
| Compound ID: | 8017-1178 |
| Compound Name: | 2-[(1,3-benzoxazol-2-yl)amino]-4-(4-fluorophenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one |
| Molecular Weight: | 404.44 |
| Molecular Formula: | C23 H21 F N4 O2 |
| Smiles: | CC1(C)CC2=C(C(c3ccc(cc3)F)N=C(N2)Nc2nc3ccccc3o2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7594 |
| logD: | 4.1146 |
| logSw: | -4.5793 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.09 |
| InChI Key: | SMQYGUCXXUDLBK-FQEVSTJZSA-N |