N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-propylurea
Chemical Structure Depiction of
N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-propylurea
N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-propylurea
Compound characteristics
| Compound ID: | V004-4815 |
| Compound Name: | N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-propylurea |
| Molecular Weight: | 442.54 |
| Molecular Formula: | C23 H31 F N6 O2 |
| Salt: | not_available |
| Smiles: | CCCNC(N(CC)CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)F)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0538 |
| logD: | 3.0519 |
| logSw: | -3.1096 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.349 |
| InChI Key: | IMYHCGRJMZTPRN-UHFFFAOYSA-N |