5-(difluoromethyl)-1-ethyl-7-(4-ethylphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
5-(difluoromethyl)-1-ethyl-7-(4-ethylphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
5-(difluoromethyl)-1-ethyl-7-(4-ethylphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y504-7654 |
| Compound Name: | 5-(difluoromethyl)-1-ethyl-7-(4-ethylphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 361.41 |
| Molecular Formula: | C18 H17 F2 N3 O S |
| Smiles: | [H]C(c1cc(c2ccc(CC)cc2)nc2c1C(N=C(N2CC)S)=O)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.6348 |
| logD: | 1.1128 |
| logSw: | -4.5765 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.91 |
| InChI Key: | BBQLJJKHMHHCRJ-UHFFFAOYSA-N |