2-(3-benzyl-8-methoxy-5-methyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)-N-(4-methylphenyl)acetamide
Chemical Structure Depiction of
2-(3-benzyl-8-methoxy-5-methyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)-N-(4-methylphenyl)acetamide
2-(3-benzyl-8-methoxy-5-methyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)-N-(4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | E737-1161 |
| Compound Name: | 2-(3-benzyl-8-methoxy-5-methyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)-N-(4-methylphenyl)acetamide |
| Molecular Weight: | 482.54 |
| Molecular Formula: | C28 H26 N4 O4 |
| Smiles: | Cc1ccc(cc1)NC(CN1C(N(Cc2ccccc2)C(c2c1c1cc(ccc1n2C)OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9135 |
| logD: | 4.9135 |
| logSw: | -4.718 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.04 |
| InChI Key: | JLVSWYHVZIXFEE-UHFFFAOYSA-N |