7-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(3-methylphenyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
7-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(3-methylphenyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
7-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(3-methylphenyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y504-7347 |
| Compound Name: | 7-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(3-methylphenyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 471.46 |
| Molecular Formula: | C23 H16 F3 N3 O3 S |
| Smiles: | Cc1cccc(c1)N1C(=NC(c2c(cc(c3ccc4c(c3)OCCO4)nc12)C(F)(F)F)=O)S |
| Stereo: | ACHIRAL |
| logP: | 4.6909 |
| logD: | -0.2781 |
| logSw: | -4.6928 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.125 |
| InChI Key: | MPIUGORSCMEOAN-UHFFFAOYSA-N |