1-cyclopentyl-5-(difluoromethyl)-7-(4-ethylphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
1-cyclopentyl-5-(difluoromethyl)-7-(4-ethylphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
1-cyclopentyl-5-(difluoromethyl)-7-(4-ethylphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y504-6694 |
| Compound Name: | 1-cyclopentyl-5-(difluoromethyl)-7-(4-ethylphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 401.48 |
| Molecular Formula: | C21 H21 F2 N3 O S |
| Smiles: | [H]C(c1cc(c2ccc(CC)cc2)nc2c1C(N=C(N2C1CCCC1)S)=O)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.3562 |
| logD: | 2.2658 |
| logSw: | -5.4103 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.501 |
| InChI Key: | FKMLXELKUWBKST-UHFFFAOYSA-N |