[4-(butylsulfanyl)-9-methyl-2-(3-methylphenyl)-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Chemical Structure Depiction of
[4-(butylsulfanyl)-9-methyl-2-(3-methylphenyl)-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
[4-(butylsulfanyl)-9-methyl-2-(3-methylphenyl)-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Compound characteristics
| Compound ID: | E544-0658 |
| Compound Name: | [4-(butylsulfanyl)-9-methyl-2-(3-methylphenyl)-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol |
| Molecular Weight: | 407.53 |
| Molecular Formula: | C23 H25 N3 O2 S |
| Smiles: | CCCCSc1c2Cc3c(CO)cnc(C)c3Oc2nc(c2cccc(C)c2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.8616 |
| logD: | 5.8587 |
| logSw: | -5.4141 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.916 |
| InChI Key: | XZUTXYMVFHISFQ-UHFFFAOYSA-N |