N-butyl-N'-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)urea
Chemical Structure Depiction of
N-butyl-N'-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)urea
N-butyl-N'-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)urea
Compound characteristics
| Compound ID: | V016-3316 |
| Compound Name: | N-butyl-N'-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)urea |
| Molecular Weight: | 456.56 |
| Molecular Formula: | C24 H33 F N6 O2 |
| Salt: | not_available |
| Smiles: | CCCCN(CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)F)nn1)=O)C(NCC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.313 |
| logD: | 3.3111 |
| logSw: | -3.3986 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.387 |
| InChI Key: | GPNRCKIFRPAUET-UHFFFAOYSA-N |