2-[(1,3-benzoxazol-2-yl)amino]-4-(3-chlorophenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Chemical Structure Depiction of
2-[(1,3-benzoxazol-2-yl)amino]-4-(3-chlorophenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one
2-[(1,3-benzoxazol-2-yl)amino]-4-(3-chlorophenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Compound characteristics
| Compound ID: | Y020-1489 |
| Compound Name: | 2-[(1,3-benzoxazol-2-yl)amino]-4-(3-chlorophenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one |
| Molecular Weight: | 420.9 |
| Molecular Formula: | C23 H21 Cl N4 O2 |
| Smiles: | CC1(C)CC2=C(C(c3cccc(c3)[Cl])N=C(N2)Nc2nc3ccccc3o2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3333 |
| logD: | 4.8884 |
| logSw: | -5.8823 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.09 |
| InChI Key: | CDTJASVPGPORPJ-FQEVSTJZSA-N |