N-(2-ethyl-6-methylphenyl)-2-{8-fluoro-3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
Chemical Structure Depiction of
N-(2-ethyl-6-methylphenyl)-2-{8-fluoro-3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
N-(2-ethyl-6-methylphenyl)-2-{8-fluoro-3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
Compound characteristics
| Compound ID: | C200-7547 |
| Compound Name: | N-(2-ethyl-6-methylphenyl)-2-{8-fluoro-3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide |
| Molecular Weight: | 498.56 |
| Molecular Formula: | C29 H27 F N4 O3 |
| Smiles: | CCc1cccc(C)c1NC(Cn1c2C(N(Cc3ccc(cc3)OC)C=Nc2c2cc(ccc12)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7884 |
| logD: | 4.7884 |
| logSw: | -4.7213 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.226 |
| InChI Key: | ONOFWCAOAZECDO-UHFFFAOYSA-N |