6-{[(4-chlorophenyl)methyl]sulfanyl}-2-[(4,6,7-trimethylquinazolin-2-yl)amino]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-{[(4-chlorophenyl)methyl]sulfanyl}-2-[(4,6,7-trimethylquinazolin-2-yl)amino]pyrimidin-4(3H)-one
6-{[(4-chlorophenyl)methyl]sulfanyl}-2-[(4,6,7-trimethylquinazolin-2-yl)amino]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8018-8479 |
| Compound Name: | 6-{[(4-chlorophenyl)methyl]sulfanyl}-2-[(4,6,7-trimethylquinazolin-2-yl)amino]pyrimidin-4(3H)-one |
| Molecular Weight: | 437.95 |
| Molecular Formula: | C22 H20 Cl N5 O S |
| Smiles: | Cc1cc2c(C)nc(NC3NC(C=C(N=3)SCc3ccc(cc3)[Cl])=O)nc2cc1C |
| Stereo: | ACHIRAL |
| logP: | 5.3656 |
| logD: | 5.3309 |
| logSw: | -5.9666 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.774 |
| InChI Key: | QKANFZWMBXGUID-UHFFFAOYSA-N |