N,3-dimethyl-2-oxo-N-[2-oxo-2-(9-oxo-2-phenyl-1,5,6,9-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-7(8H)-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Chemical Structure Depiction of
N,3-dimethyl-2-oxo-N-[2-oxo-2-(9-oxo-2-phenyl-1,5,6,9-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-7(8H)-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
N,3-dimethyl-2-oxo-N-[2-oxo-2-(9-oxo-2-phenyl-1,5,6,9-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-7(8H)-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Compound characteristics
| Compound ID: | S022-1766 |
| Compound Name: | N,3-dimethyl-2-oxo-N-[2-oxo-2-(9-oxo-2-phenyl-1,5,6,9-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-7(8H)-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide |
| Molecular Weight: | 548.58 |
| Molecular Formula: | C26 H24 N6 O6 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N(C)CC(N1CCC2=C(C1)C(N1C(C=C(c3ccccc3)N1)=N2)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9805 |
| logD: | 0.9803 |
| logSw: | -2.5146 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.968 |
| InChI Key: | KWJGBFBHMLIBLK-UHFFFAOYSA-N |