6-(3,5-difluorobenzene-1-sulfonyl)-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Chemical Structure Depiction of
6-(3,5-difluorobenzene-1-sulfonyl)-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
6-(3,5-difluorobenzene-1-sulfonyl)-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Compound characteristics
| Compound ID: | S021-1202 |
| Compound Name: | 6-(3,5-difluorobenzene-1-sulfonyl)-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one |
| Molecular Weight: | 442.44 |
| Molecular Formula: | C21 H16 F2 N4 O3 S |
| Smiles: | C1CN(CC2=C1C(N1C(C=C(c3ccccc3)N1)=N2)=O)S(c1cc(cc(c1)F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7917 |
| logD: | 2.7914 |
| logSw: | -3.5221 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.856 |
| InChI Key: | YTMQPKMRRGYMCW-UHFFFAOYSA-N |