2-{5-[(3-chlorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-(2,3-dimethylcyclohexyl)acetamide
Chemical Structure Depiction of
2-{5-[(3-chlorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-(2,3-dimethylcyclohexyl)acetamide
2-{5-[(3-chlorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-(2,3-dimethylcyclohexyl)acetamide
Compound characteristics
| Compound ID: | C880-2798 |
| Compound Name: | 2-{5-[(3-chlorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-(2,3-dimethylcyclohexyl)acetamide |
| Molecular Weight: | 477.01 |
| Molecular Formula: | C27 H29 Cl N4 O2 |
| Smiles: | CC1CCCC(C1C)NC(CN1C(c2c(C=N1)c1ccccc1n2Cc1cccc(c1)[Cl])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8681 |
| logD: | 4.8681 |
| logSw: | -4.8871 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.658 |
| InChI Key: | KEKQLHYKNNTCOA-UHFFFAOYSA-N |