5-(difluoromethyl)-7-(1-methyl-1H-pyrazol-4-yl)-1-(prop-2-en-1-yl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
5-(difluoromethyl)-7-(1-methyl-1H-pyrazol-4-yl)-1-(prop-2-en-1-yl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
5-(difluoromethyl)-7-(1-methyl-1H-pyrazol-4-yl)-1-(prop-2-en-1-yl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y504-7363 |
| Compound Name: | 5-(difluoromethyl)-7-(1-methyl-1H-pyrazol-4-yl)-1-(prop-2-en-1-yl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 349.36 |
| Molecular Formula: | C15 H13 F2 N5 O S |
| Smiles: | [H]C(c1cc(c2cnn(C)c2)nc2c1C(N=C(N2CC=C)S)=O)(F)F |
| Stereo: | ACHIRAL |
| logP: | 1.9008 |
| logD: | -2.053 |
| logSw: | -2.1916 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.973 |
| InChI Key: | NITOQLRJRSCDQA-UHFFFAOYSA-N |