7-(4-bromophenyl)-1-(3-methoxypropyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
7-(4-bromophenyl)-1-(3-methoxypropyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
7-(4-bromophenyl)-1-(3-methoxypropyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y504-7520 |
| Compound Name: | 7-(4-bromophenyl)-1-(3-methoxypropyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 474.3 |
| Molecular Formula: | C18 H15 Br F3 N3 O2 S |
| Smiles: | COCCCN1C(=NC(c2c(cc(c3ccc(cc3)[Br])nc12)C(F)(F)F)=O)S |
| Stereo: | ACHIRAL |
| logP: | 5.1561 |
| logD: | 1.634 |
| logSw: | -5.0843 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.506 |
| InChI Key: | QSXOWVMVSUUNID-UHFFFAOYSA-N |