3-(3-chloro-4-methoxyphenyl)-N-[2-(4-chlorophenyl)ethyl]-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Chemical Structure Depiction of
3-(3-chloro-4-methoxyphenyl)-N-[2-(4-chlorophenyl)ethyl]-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
3-(3-chloro-4-methoxyphenyl)-N-[2-(4-chlorophenyl)ethyl]-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Compound characteristics
| Compound ID: | C507-0166 |
| Compound Name: | 3-(3-chloro-4-methoxyphenyl)-N-[2-(4-chlorophenyl)ethyl]-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 521.4 |
| Molecular Formula: | C27 H22 Cl2 N4 O3 |
| Smiles: | Cn1c2C(N(c3ccc(c(c3)[Cl])OC)N=C(C(NCCc3ccc(cc3)[Cl])=O)c2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6918 |
| logD: | 4.6918 |
| logSw: | -5.0973 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.856 |
| InChI Key: | BXJIPQNGQBMFJW-UHFFFAOYSA-N |