N-{2-[butyl(methyl)amino]ethyl}-3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Chemical Structure Depiction of
N-{2-[butyl(methyl)amino]ethyl}-3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
N-{2-[butyl(methyl)amino]ethyl}-3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Compound characteristics
| Compound ID: | C507-0216 |
| Compound Name: | N-{2-[butyl(methyl)amino]ethyl}-3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 496.01 |
| Molecular Formula: | C26 H30 Cl N5 O3 |
| Smiles: | CCCCN(C)CCNC(C1c2c3ccccc3n(C)c2C(N(c2ccc(c(c2)[Cl])OC)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6713 |
| logD: | 2.4372 |
| logSw: | -4.5156 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.2 |
| InChI Key: | MFJDXOFDDJFOMT-UHFFFAOYSA-N |