N-(2H-1,3-benzodioxol-5-yl)-N~2~-(3-chloro-4-methoxybenzene-1-sulfonyl)-N~2~-cyclohexylglycinamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-N~2~-(3-chloro-4-methoxybenzene-1-sulfonyl)-N~2~-cyclohexylglycinamide
N-(2H-1,3-benzodioxol-5-yl)-N~2~-(3-chloro-4-methoxybenzene-1-sulfonyl)-N~2~-cyclohexylglycinamide
Compound characteristics
| Compound ID: | Y050-0625 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-N~2~-(3-chloro-4-methoxybenzene-1-sulfonyl)-N~2~-cyclohexylglycinamide |
| Molecular Weight: | 480.97 |
| Molecular Formula: | C22 H25 Cl N2 O6 S |
| Smiles: | COc1ccc(cc1[Cl])S(N(CC(Nc1ccc2c(c1)OCO2)=O)C1CCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5364 |
| logD: | 4.5361 |
| logSw: | -4.6164 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.521 |
| InChI Key: | ITRJZBZXRRBLDM-UHFFFAOYSA-N |