N-[3-(4-benzylpiperidin-1-yl)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-(4-benzylpiperidin-1-yl)propyl]-3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
N-[3-(4-benzylpiperidin-1-yl)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: | C066-3053 |
| Compound Name: | N-[3-(4-benzylpiperidin-1-yl)propyl]-3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 598.15 |
| Molecular Formula: | C34 H36 Cl N5 O3 |
| Smiles: | Cn1c2C(N(c3ccc(c(c3)[Cl])OC)N=C(C(NCCCN3CCC(CC3)Cc3ccccc3)=O)c2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.497 |
| logD: | 3.4625 |
| logSw: | -6.1405 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.567 |
| InChI Key: | SYSZFUAPSBPEEM-UHFFFAOYSA-N |