2-[5,8-dimethyl-3-(3-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(3-ethylphenyl)acetamide
Chemical Structure Depiction of
2-[5,8-dimethyl-3-(3-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(3-ethylphenyl)acetamide
2-[5,8-dimethyl-3-(3-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(3-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | E737-0213 |
| Compound Name: | 2-[5,8-dimethyl-3-(3-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(3-ethylphenyl)acetamide |
| Molecular Weight: | 480.57 |
| Molecular Formula: | C29 H28 N4 O3 |
| Smiles: | CCc1cccc(c1)NC(CN1C(N(C(c2c1c1cc(C)ccc1n2C)=O)c1cccc(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4872 |
| logD: | 5.4872 |
| logSw: | -5.3705 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.885 |
| InChI Key: | BCMYKYJZGDVGQF-UHFFFAOYSA-N |