N-(4-fluorophenyl)-2-{[6-(hydroxymethyl)-2-(3-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl]sulfanyl}butanamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-{[6-(hydroxymethyl)-2-(3-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl]sulfanyl}butanamide
N-(4-fluorophenyl)-2-{[6-(hydroxymethyl)-2-(3-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl]sulfanyl}butanamide
Compound characteristics
| Compound ID: | E544-0483 |
| Compound Name: | N-(4-fluorophenyl)-2-{[6-(hydroxymethyl)-2-(3-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl]sulfanyl}butanamide |
| Molecular Weight: | 546.62 |
| Molecular Formula: | C29 H27 F N4 O4 S |
| Smiles: | CCC(C(Nc1ccc(cc1)F)=O)Sc1c2Cc3c(CO)cnc(C)c3Oc2nc(c2cccc(c2)OC)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.995 |
| logD: | 5.9921 |
| logSw: | -5.4273 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.551 |
| InChI Key: | YSCZMKFVHMEQJQ-DEOSSOPVSA-N |