1-[(2,5-dimethylphenyl)methyl]-8-methoxy-3-(4-methoxyphenyl)-5-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Chemical Structure Depiction of
1-[(2,5-dimethylphenyl)methyl]-8-methoxy-3-(4-methoxyphenyl)-5-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
1-[(2,5-dimethylphenyl)methyl]-8-methoxy-3-(4-methoxyphenyl)-5-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Compound characteristics
| Compound ID: | E737-1047 |
| Compound Name: | 1-[(2,5-dimethylphenyl)methyl]-8-methoxy-3-(4-methoxyphenyl)-5-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione |
| Molecular Weight: | 469.54 |
| Molecular Formula: | C28 H27 N3 O4 |
| Smiles: | Cc1ccc(C)c(CN2C(N(C(c3c2c2cc(ccc2n3C)OC)=O)c2ccc(cc2)OC)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.3911 |
| logD: | 5.3911 |
| logSw: | -5.3787 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.823 |
| InChI Key: | NDWRIMDLRVQUFG-UHFFFAOYSA-N |