N-{2-[2-(2-chlorophenyl)-9-oxo-5,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-6(1H)-yl]-2-oxoethyl}-N-methylthiophene-2-sulfonamide
Chemical Structure Depiction of
N-{2-[2-(2-chlorophenyl)-9-oxo-5,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-6(1H)-yl]-2-oxoethyl}-N-methylthiophene-2-sulfonamide
N-{2-[2-(2-chlorophenyl)-9-oxo-5,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-6(1H)-yl]-2-oxoethyl}-N-methylthiophene-2-sulfonamide
Compound characteristics
| Compound ID: | S021-2172 |
| Compound Name: | N-{2-[2-(2-chlorophenyl)-9-oxo-5,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-6(1H)-yl]-2-oxoethyl}-N-methylthiophene-2-sulfonamide |
| Molecular Weight: | 518.01 |
| Molecular Formula: | C22 H20 Cl N5 O4 S2 |
| Smiles: | CN(CC(N1CCC2=C(C1)N=C1C=C(c3ccccc3[Cl])NN1C2=O)=O)S(c1cccs1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.867 |
| logD: | 1.8661 |
| logSw: | -3.1627 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.12 |
| InChI Key: | BKPUQVKZMPNLJM-UHFFFAOYSA-N |