2-{3-[(2-chlorophenyl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2,4,6-trimethylphenyl)acetamide
Chemical Structure Depiction of
2-{3-[(2-chlorophenyl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2,4,6-trimethylphenyl)acetamide
2-{3-[(2-chlorophenyl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2,4,6-trimethylphenyl)acetamide
Compound characteristics
| Compound ID: | F394-0555 |
| Compound Name: | 2-{3-[(2-chlorophenyl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-(2,4,6-trimethylphenyl)acetamide |
| Molecular Weight: | 499.01 |
| Molecular Formula: | C29 H27 Cl N4 O2 |
| Smiles: | Cc1ccc2c(c1)c1c(C(N(Cc3ccccc3[Cl])C=N1)=O)n2CC(Nc1c(C)cc(C)cc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8584 |
| logD: | 5.8583 |
| logSw: | -5.9646 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.682 |
| InChI Key: | GNQYLMOGZWAYAA-UHFFFAOYSA-N |