N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-ethyl-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-ethyl-4-methylbenzene-1-sulfonamide
N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-ethyl-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V008-5649 |
| Compound Name: | N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-ethyl-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 528.07 |
| Molecular Formula: | C26 H30 Cl N5 O3 S |
| Salt: | not_available |
| Smiles: | CCN(CC(N1CCCN(CC1)c1ccc(c2ccccc2[Cl])nn1)=O)S(c1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1366 |
| logD: | 4.1305 |
| logSw: | -4.3844 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.257 |
| InChI Key: | VMYINDRDVRGTTH-UHFFFAOYSA-N |