N-benzyl-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-propylurea
Chemical Structure Depiction of
N-benzyl-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-propylurea
N-benzyl-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-propylurea
Compound characteristics
| Compound ID: | V023-4875 |
| Compound Name: | N-benzyl-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-propylurea |
| Molecular Weight: | 521.06 |
| Molecular Formula: | C28 H33 Cl N6 O2 |
| Salt: | not_available |
| Smiles: | CCCNC(N(CC(N1CCCN(CC1)c1ccc(c2ccccc2[Cl])nn1)=O)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3139 |
| logD: | 4.3077 |
| logSw: | -4.5075 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.353 |
| InChI Key: | SDNMTKHAOAUURJ-UHFFFAOYSA-N |