2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(4-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(4-methoxyphenyl)methyl]acetamide
2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(4-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | F796-0463 |
| Compound Name: | 2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(4-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 422.44 |
| Molecular Formula: | C22 H22 N4 O5 |
| Smiles: | COc1ccc(CNC(CN2C=Nc3c4cc(c(cc4[nH]c3C2=O)OC)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.2867 |
| logD: | 1.2867 |
| logSw: | -2.3457 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.573 |
| InChI Key: | CQZFBTGMVZRHFL-UHFFFAOYSA-N |