2-[5,8-dimethyl-3-(2-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(2,5-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-[5,8-dimethyl-3-(2-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(2,5-dimethylphenyl)acetamide
2-[5,8-dimethyl-3-(2-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(2,5-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | E737-0397 |
| Compound Name: | 2-[5,8-dimethyl-3-(2-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(2,5-dimethylphenyl)acetamide |
| Molecular Weight: | 480.57 |
| Molecular Formula: | C29 H28 N4 O3 |
| Smiles: | Cc1ccc(C)c(c1)NC(CN1C(N(C(c2c1c1cc(C)ccc1n2C)=O)c1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7856 |
| logD: | 4.7856 |
| logSw: | -4.5938 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.886 |
| InChI Key: | NZSIKYOZSOZQCX-UHFFFAOYSA-N |