N-butyl-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-propylurea
Chemical Structure Depiction of
N-butyl-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-propylurea
N-butyl-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-propylurea
Compound characteristics
Compound ID: | V003-6590 |
Compound Name: | N-butyl-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-propylurea |
Molecular Weight: | 482.63 |
Molecular Formula: | C26 H38 N6 O3 |
Salt: | not_available |
Smiles: | CCCCN(CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)OC)nn1)=O)C(NCCC)=O |
Stereo: | ACHIRAL |
logP: | 3.9761 |
logD: | 3.9723 |
logSw: | -3.8871 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.146 |
InChI Key: | VGDISSRHGOZFAY-UHFFFAOYSA-N |