2-(5,8-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)-N-(2,4,6-trimethylphenyl)acetamide
Chemical Structure Depiction of
2-(5,8-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)-N-(2,4,6-trimethylphenyl)acetamide
2-(5,8-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)-N-(2,4,6-trimethylphenyl)acetamide
Compound characteristics
| Compound ID: | E737-0518 |
| Compound Name: | 2-(5,8-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)-N-(2,4,6-trimethylphenyl)acetamide |
| Molecular Weight: | 480.57 |
| Molecular Formula: | C29 H28 N4 O3 |
| Smiles: | Cc1ccc2c(c1)c1c(C(N(C(N1CC(Nc1c(C)cc(C)cc1C)=O)=O)c1ccccc1)=O)n2C |
| Stereo: | ACHIRAL |
| logP: | 4.59 |
| logD: | 4.59 |
| logSw: | -4.3004 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.489 |
| InChI Key: | PKRGAHGVWYPJRZ-UHFFFAOYSA-N |