N-butyl-N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)cyclobutanecarboxamide
Chemical Structure Depiction of
N-butyl-N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)cyclobutanecarboxamide
N-butyl-N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)cyclobutanecarboxamide
Compound characteristics
| Compound ID: | V027-8488 |
| Compound Name: | N-butyl-N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)cyclobutanecarboxamide |
| Molecular Weight: | 509.65 |
| Molecular Formula: | C28 H39 N5 O4 |
| Salt: | not_available |
| Smiles: | CCCCN(CC(N1CCCN(CC1)c1ccc(c2ccc(c(c2)OC)OC)nn1)=O)C(C1CCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1033 |
| logD: | 2.9903 |
| logSw: | -2.9898 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.131 |
| InChI Key: | KPIVKVGLBMSRCR-UHFFFAOYSA-N |