N-(3-bromophenyl)-2-{[7-(4-methoxyphenyl)pyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-bromophenyl)-2-{[7-(4-methoxyphenyl)pyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}acetamide
N-(3-bromophenyl)-2-{[7-(4-methoxyphenyl)pyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | M143-0680 |
| Compound Name: | N-(3-bromophenyl)-2-{[7-(4-methoxyphenyl)pyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 482.36 |
| Molecular Formula: | C21 H16 Br N5 O2 S |
| Smiles: | COc1ccc(cc1)c1ncc2c(ncnc2n1)SCC(Nc1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8282 |
| logD: | 4.828 |
| logSw: | -4.5842 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.464 |
| InChI Key: | GIDNJWCWNZBFBW-UHFFFAOYSA-N |