7-tert-butyl-1-cyclopropyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
7-tert-butyl-1-cyclopropyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
7-tert-butyl-1-cyclopropyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y501-3909 |
| Compound Name: | 7-tert-butyl-1-cyclopropyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 343.37 |
| Molecular Formula: | C15 H16 F3 N3 O S |
| Smiles: | CC(C)(C)c1cc(c2C(N=C(N(C3CC3)c2n1)S)=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.1394 |
| logD: | 1.0546 |
| logSw: | -4.4218 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.738 |
| InChI Key: | NZIJXWQYOHHHFJ-UHFFFAOYSA-N |