3-(3-chloro-4-methoxyphenyl)-5-methyl-N-(2-methyl-3-nitrophenyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Chemical Structure Depiction of
3-(3-chloro-4-methoxyphenyl)-5-methyl-N-(2-methyl-3-nitrophenyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
3-(3-chloro-4-methoxyphenyl)-5-methyl-N-(2-methyl-3-nitrophenyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Compound characteristics
| Compound ID: | C507-0194 |
| Compound Name: | 3-(3-chloro-4-methoxyphenyl)-5-methyl-N-(2-methyl-3-nitrophenyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 517.93 |
| Molecular Formula: | C26 H20 Cl N5 O5 |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)NC(C1c2c3ccccc3n(C)c2C(N(c2ccc(c(c2)[Cl])OC)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6762 |
| logD: | 4.6575 |
| logSw: | -5.2336 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.075 |
| InChI Key: | CRLJUGAGAANUGG-UHFFFAOYSA-N |