N-[(2,5-dimethoxyphenyl)methyl]-2-(4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
Chemical Structure Depiction of
N-[(2,5-dimethoxyphenyl)methyl]-2-(4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
N-[(2,5-dimethoxyphenyl)methyl]-2-(4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
Compound characteristics
| Compound ID: | F796-0546 |
| Compound Name: | N-[(2,5-dimethoxyphenyl)methyl]-2-(4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide |
| Molecular Weight: | 392.41 |
| Molecular Formula: | C21 H20 N4 O4 |
| Smiles: | COc1ccc(c(CNC(CN2C=Nc3c4ccccc4[nH]c3C2=O)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 1.8959 |
| logD: | 1.8959 |
| logSw: | -2.832 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.943 |
| InChI Key: | NGXHYKZHMTVRME-UHFFFAOYSA-N |