2-phenyl-6-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Chemical Structure Depiction of
2-phenyl-6-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
2-phenyl-6-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Compound characteristics
| Compound ID: | S021-1036 |
| Compound Name: | 2-phenyl-6-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one |
| Molecular Weight: | 430.53 |
| Molecular Formula: | C24 H22 N4 O2 S |
| Smiles: | C1CCc2c(C1)cc(C(N1CCC3=C(C1)N=C1C=C(c4ccccc4)NN1C3=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.5279 |
| logD: | 3.5278 |
| logSw: | -3.719 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.733 |
| InChI Key: | LOIKVWOTTQMVJJ-UHFFFAOYSA-N |