6-{[(4-chlorophenyl)sulfanyl]methyl}-2-[(4,8-dimethylquinazolin-2-yl)amino]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-{[(4-chlorophenyl)sulfanyl]methyl}-2-[(4,8-dimethylquinazolin-2-yl)amino]pyrimidin-4(3H)-one
6-{[(4-chlorophenyl)sulfanyl]methyl}-2-[(4,8-dimethylquinazolin-2-yl)amino]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 6809-0229 |
| Compound Name: | 6-{[(4-chlorophenyl)sulfanyl]methyl}-2-[(4,8-dimethylquinazolin-2-yl)amino]pyrimidin-4(3H)-one |
| Molecular Weight: | 423.92 |
| Molecular Formula: | C21 H18 Cl N5 O S |
| Smiles: | Cc1cccc2c(C)nc(NC3NC(C=C(CSc4ccc(cc4)[Cl])N=3)=O)nc12 |
| Stereo: | ACHIRAL |
| logP: | 5.0474 |
| logD: | 4.8419 |
| logSw: | -5.1494 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.46 |
| InChI Key: | PJUVXIYUNQSANS-UHFFFAOYSA-N |