N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-cyclohexyl-N~2~-(4-methylbenzene-1-sulfonyl)-N-[(3-methylthiophen-2-yl)methyl]glycinamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-cyclohexyl-N~2~-(4-methylbenzene-1-sulfonyl)-N-[(3-methylthiophen-2-yl)methyl]glycinamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-cyclohexyl-N~2~-(4-methylbenzene-1-sulfonyl)-N-[(3-methylthiophen-2-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | V026-6487 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-cyclohexyl-N~2~-(4-methylbenzene-1-sulfonyl)-N-[(3-methylthiophen-2-yl)methyl]glycinamide |
| Molecular Weight: | 554.73 |
| Molecular Formula: | C29 H34 N2 O5 S2 |
| Smiles: | Cc1ccc(cc1)S(N(CC(N(Cc1ccc2c(c1)OCO2)Cc1c(C)ccs1)=O)C1CCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0858 |
| logD: | 6.0858 |
| logSw: | -5.3083 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.443 |
| InChI Key: | GJRSZAOEMIGNCS-UHFFFAOYSA-N |