N-[2-(azepan-1-yl)ethyl]-1-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-1-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F707-2020 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide |
| Molecular Weight: | 482.03 |
| Molecular Formula: | C25 H32 Cl N7 O |
| Smiles: | C1CCCN(CC1)CCNC(C1CCN(CC1)c1ccc2nnc(c3ccc(cc3)[Cl])n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8841 |
| logD: | 2.1014 |
| logSw: | -4.4061 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.881 |
| InChI Key: | ZNDWBTMDROJHGD-UHFFFAOYSA-N |