[4-(butylsulfanyl)-9-methyl-2-phenyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Chemical Structure Depiction of
[4-(butylsulfanyl)-9-methyl-2-phenyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
[4-(butylsulfanyl)-9-methyl-2-phenyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Compound characteristics
| Compound ID: | E544-0003 |
| Compound Name: | [4-(butylsulfanyl)-9-methyl-2-phenyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol |
| Molecular Weight: | 393.51 |
| Molecular Formula: | C22 H23 N3 O2 S |
| Smiles: | CCCCSc1c2Cc3c(CO)cnc(C)c3Oc2nc(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.3873 |
| logD: | 5.3844 |
| logSw: | -5.3269 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.916 |
| InChI Key: | MBBCCJXRPZBGGZ-UHFFFAOYSA-N |