N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-ethyl-N-(prop-2-en-1-yl)urea
Chemical Structure Depiction of
N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-ethyl-N-(prop-2-en-1-yl)urea
N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-ethyl-N-(prop-2-en-1-yl)urea
Compound characteristics
| Compound ID: | V016-1799 |
| Compound Name: | N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-ethyl-N-(prop-2-en-1-yl)urea |
| Molecular Weight: | 456.97 |
| Molecular Formula: | C23 H29 Cl N6 O2 |
| Salt: | not_available |
| Smiles: | CCNC(N(CC=C)CC(N1CCCN(CC1)c1ccc(c2ccccc2[Cl])nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7765 |
| logD: | 2.7704 |
| logSw: | -3.6835 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.387 |
| InChI Key: | HOHMDIOFCSFXNR-UHFFFAOYSA-N |