2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(3,5-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(3,5-dimethoxyphenyl)acetamide
2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(3,5-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | F796-0484 |
| Compound Name: | 2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(3,5-dimethoxyphenyl)acetamide |
| Molecular Weight: | 438.44 |
| Molecular Formula: | C22 H22 N4 O6 |
| Smiles: | COc1cc(cc(c1)OC)NC(CN1C=Nc2c3cc(c(cc3[nH]c2C1=O)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8656 |
| logD: | 1.8655 |
| logSw: | -2.541 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.795 |
| InChI Key: | IGNUXJSLVDWWEC-UHFFFAOYSA-N |