[4-{[(4-bromophenyl)methyl]sulfanyl}-2-(2-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Chemical Structure Depiction of
[4-{[(4-bromophenyl)methyl]sulfanyl}-2-(2-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
[4-{[(4-bromophenyl)methyl]sulfanyl}-2-(2-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Compound characteristics
| Compound ID: | E544-0931 |
| Compound Name: | [4-{[(4-bromophenyl)methyl]sulfanyl}-2-(2-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol |
| Molecular Weight: | 536.45 |
| Molecular Formula: | C26 H22 Br N3 O3 S |
| Smiles: | Cc1c2c(Cc3c(nc(c4ccccc4OC)nc3SCc3ccc(cc3)[Br])O2)c(CO)cn1 |
| Stereo: | ACHIRAL |
| logP: | 5.0448 |
| logD: | 5.0419 |
| logSw: | -4.6322 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.275 |
| InChI Key: | UJERABRGGTVQNZ-UHFFFAOYSA-N |