7-(4-bromophenyl)-5-(difluoromethyl)-1-(2-methoxyethyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
7-(4-bromophenyl)-5-(difluoromethyl)-1-(2-methoxyethyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
7-(4-bromophenyl)-5-(difluoromethyl)-1-(2-methoxyethyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y504-7178 |
| Compound Name: | 7-(4-bromophenyl)-5-(difluoromethyl)-1-(2-methoxyethyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 442.28 |
| Molecular Formula: | C17 H14 Br F2 N3 O2 S |
| Smiles: | [H]C(c1cc(c2ccc(cc2)[Br])nc2c1C(N=C(N2CCOC)S)=O)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.059 |
| logD: | 0.537 |
| logSw: | -4.3635 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.506 |
| InChI Key: | PICHCNADCJKRNP-UHFFFAOYSA-N |