2-[(1,3-benzothiazol-2-yl)amino]-7,7-dimethyl-4-phenyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Chemical Structure Depiction of
2-[(1,3-benzothiazol-2-yl)amino]-7,7-dimethyl-4-phenyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one
2-[(1,3-benzothiazol-2-yl)amino]-7,7-dimethyl-4-phenyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Compound characteristics
| Compound ID: | Y020-1084 |
| Compound Name: | 2-[(1,3-benzothiazol-2-yl)amino]-7,7-dimethyl-4-phenyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one |
| Molecular Weight: | 402.52 |
| Molecular Formula: | C23 H22 N4 O S |
| Smiles: | CC1(C)CC2=C(C(c3ccccc3)N=C(N2)Nc2nc3ccccc3s2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5028 |
| logD: | 4.8579 |
| logSw: | -5.4791 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.457 |
| InChI Key: | YMIREIBPQIBICZ-FQEVSTJZSA-N |