N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)-N'-propylurea
Chemical Structure Depiction of
N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)-N'-propylurea
N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)-N'-propylurea
Compound characteristics
| Compound ID: | V028-5906 |
| Compound Name: | N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)-N'-propylurea |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C24 H31 F N6 O2 |
| Smiles: | CCCNC(N(CC=C)CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)F)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2604 |
| logD: | 3.2586 |
| logSw: | -3.2333 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.603 |
| InChI Key: | ZGYYNTJJOTVYEQ-UHFFFAOYSA-N |