(4-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-9-methyl-2-phenyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl)methanol
Chemical Structure Depiction of
(4-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-9-methyl-2-phenyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl)methanol
(4-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-9-methyl-2-phenyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl)methanol
Compound characteristics
| Compound ID: | E544-0790 |
| Compound Name: | (4-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-9-methyl-2-phenyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl)methanol |
| Molecular Weight: | 479.96 |
| Molecular Formula: | C25 H19 Cl F N3 O2 S |
| Smiles: | Cc1c2c(Cc3c(nc(c4ccccc4)nc3SCc3ccc(cc3[Cl])F)O2)c(CO)cn1 |
| Stereo: | ACHIRAL |
| logP: | 6.3244 |
| logD: | 6.3216 |
| logSw: | -6.0187 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.644 |
| InChI Key: | BMSPMEMTOJSTRI-UHFFFAOYSA-N |