2-{3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2-ethyl-6-methylphenyl)acetamide
Chemical Structure Depiction of
2-{3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2-ethyl-6-methylphenyl)acetamide
2-{3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2-ethyl-6-methylphenyl)acetamide
Compound characteristics
| Compound ID: | C200-7546 |
| Compound Name: | 2-{3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2-ethyl-6-methylphenyl)acetamide |
| Molecular Weight: | 484.99 |
| Molecular Formula: | C28 H25 Cl N4 O2 |
| Smiles: | CCc1cccc(C)c1NC(Cn1c2C(N(Cc3ccccc3[Cl])C=Nc2c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4441 |
| logD: | 5.4441 |
| logSw: | -5.8532 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.682 |
| InChI Key: | HTQMCRJMNKIVRJ-UHFFFAOYSA-N |