2-phenyl-7-[5-(trifluoromethyl)thiophene-2-carbonyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one
Chemical Structure Depiction of
2-phenyl-7-[5-(trifluoromethyl)thiophene-2-carbonyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one
2-phenyl-7-[5-(trifluoromethyl)thiophene-2-carbonyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one
Compound characteristics
| Compound ID: | S022-1033 |
| Compound Name: | 2-phenyl-7-[5-(trifluoromethyl)thiophene-2-carbonyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one |
| Molecular Weight: | 444.43 |
| Molecular Formula: | C21 H15 F3 N4 O2 S |
| Smiles: | C1CN(CC2=C1N=C1C=C(c3ccccc3)NN1C2=O)C(c1ccc(C(F)(F)F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4238 |
| logD: | 3.4236 |
| logSw: | -3.6412 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.812 |
| InChI Key: | MRHFLJPNTOAXMG-UHFFFAOYSA-N |