N-ethyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-ethyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-4-methylbenzene-1-sulfonamide
N-ethyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V016-7108 |
| Compound Name: | N-ethyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 523.65 |
| Molecular Formula: | C27 H33 N5 O4 S |
| Smiles: | CCN(CC(N1CCCN(CC1)c1ccc(c2cccc(c2)OC)nn1)=O)S(c1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8203 |
| logD: | 3.6503 |
| logSw: | -3.8846 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.801 |
| InChI Key: | XTCHNXFNADHUPC-UHFFFAOYSA-N |