N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-(4-chlorobenzene-1-sulfonyl)-N~2~-(3-ethoxypropyl)-N-[(3-methylthiophen-2-yl)methyl]glycinamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-(4-chlorobenzene-1-sulfonyl)-N~2~-(3-ethoxypropyl)-N-[(3-methylthiophen-2-yl)methyl]glycinamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-(4-chlorobenzene-1-sulfonyl)-N~2~-(3-ethoxypropyl)-N-[(3-methylthiophen-2-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | V009-9338 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-(4-chlorobenzene-1-sulfonyl)-N~2~-(3-ethoxypropyl)-N-[(3-methylthiophen-2-yl)methyl]glycinamide |
| Molecular Weight: | 579.13 |
| Molecular Formula: | C27 H31 Cl N2 O6 S2 |
| Smiles: | CCOCCCN(CC(N(Cc1ccc2c(c1)OCO2)Cc1c(C)ccs1)=O)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0053 |
| logD: | 5.0053 |
| logSw: | -5.0498 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.387 |
| InChI Key: | QQIYMHBUSULADE-UHFFFAOYSA-N |