N-(5-chloro-2,4-dimethoxyphenyl)-2-(4-oxo-5-propyl-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-(4-oxo-5-propyl-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
N-(5-chloro-2,4-dimethoxyphenyl)-2-(4-oxo-5-propyl-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
Compound characteristics
Compound ID: | E717-0024 |
Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-(4-oxo-5-propyl-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide |
Molecular Weight: | 454.91 |
Molecular Formula: | C23 H23 Cl N4 O4 |
Smiles: | CCCn1c2C(N(CC(Nc3cc(c(cc3OC)OC)[Cl])=O)N=Cc2c2ccccc12)=O |
Stereo: | ACHIRAL |
logP: | 3.864 |
logD: | 3.8603 |
logSw: | -4.2225 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.034 |
InChI Key: | DTHKXDZTPYWSAG-UHFFFAOYSA-N |