2-{3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(oxolan-2-yl)methyl]acetamide
2-{3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C200-6757 |
| Compound Name: | 2-{3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 446.51 |
| Molecular Formula: | C25 H26 N4 O4 |
| Smiles: | COc1ccc(CN2C=Nc3c4ccccc4n(CC(NCC4CCCO4)=O)c3C2=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9726 |
| logD: | 1.9726 |
| logSw: | -2.5019 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.598 |
| InChI Key: | PTPFQFKIAVBCJC-LJQANCHMSA-N |