2-[5,8-dimethyl-3-(4-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(2-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[5,8-dimethyl-3-(4-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(2-ethoxyphenyl)acetamide
2-[5,8-dimethyl-3-(4-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(2-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | E737-0049 |
| Compound Name: | 2-[5,8-dimethyl-3-(4-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(2-ethoxyphenyl)acetamide |
| Molecular Weight: | 496.57 |
| Molecular Formula: | C29 H28 N4 O4 |
| Smiles: | CCOc1ccccc1NC(CN1C(N(C(c2c1c1cc(C)ccc1n2C)=O)c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7963 |
| logD: | 4.7963 |
| logSw: | -4.508 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.397 |
| InChI Key: | VMEGPOILUQTWSD-UHFFFAOYSA-N |