[4-{[(4-ethenylphenyl)methyl]sulfanyl}-2-(3-fluorophenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Chemical Structure Depiction of
[4-{[(4-ethenylphenyl)methyl]sulfanyl}-2-(3-fluorophenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
[4-{[(4-ethenylphenyl)methyl]sulfanyl}-2-(3-fluorophenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Compound characteristics
| Compound ID: | E544-0775 |
| Compound Name: | [4-{[(4-ethenylphenyl)methyl]sulfanyl}-2-(3-fluorophenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol |
| Molecular Weight: | 471.55 |
| Molecular Formula: | C27 H22 F N3 O2 S |
| Smiles: | Cc1c2c(Cc3c(nc(c4cccc(c4)F)nc3SCc3ccc(C=C)cc3)O2)c(CO)cn1 |
| Stereo: | ACHIRAL |
| logP: | 5.9676 |
| logD: | 5.9648 |
| logSw: | -5.6602 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.644 |
| InChI Key: | NFDIUTCRIPEIJJ-UHFFFAOYSA-N |