N-{3-[benzyl(ethyl)amino]propyl}-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-{3-[benzyl(ethyl)amino]propyl}-3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
N-{3-[benzyl(ethyl)amino]propyl}-3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Compound characteristics
| Compound ID: | C507-0104 |
| Compound Name: | N-{3-[benzyl(ethyl)amino]propyl}-3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 558.08 |
| Molecular Formula: | C31 H32 Cl N5 O3 |
| Smiles: | CCN(CCCNC(C1c2c3ccccc3n(C)c2C(N(c2ccc(c(c2)[Cl])OC)N=1)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5115 |
| logD: | 2.9212 |
| logSw: | -4.9071 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.542 |
| InChI Key: | KQXUVOTYENPNKJ-UHFFFAOYSA-N |