6-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-2-[(6-ethoxy-4-methylquinazolin-2-yl)amino]pyrimidin-4-ol
Chemical Structure Depiction of
6-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-2-[(6-ethoxy-4-methylquinazolin-2-yl)amino]pyrimidin-4-ol
6-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-2-[(6-ethoxy-4-methylquinazolin-2-yl)amino]pyrimidin-4-ol
Compound characteristics
| Compound ID: | 3391-6890 |
| Compound Name: | 6-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-2-[(6-ethoxy-4-methylquinazolin-2-yl)amino]pyrimidin-4-ol |
| Molecular Weight: | 476.58 |
| Molecular Formula: | C23 H20 N6 O2 S2 |
| Smiles: | CCOc1ccc2c(c1)c(C)nc(Nc1nc(CSc3nc4ccccc4s3)cc(n1)O)n2 |
| Stereo: | ACHIRAL |
| logP: | 6.0935 |
| logD: | 6.0935 |
| logSw: | -5.4783 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.541 |
| InChI Key: | WRKWXGWILQQRIV-UHFFFAOYSA-N |