N,N-diethyl-4-[(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)amino]benzene-1-sulfonamide
Chemical Structure Depiction of
N,N-diethyl-4-[(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)amino]benzene-1-sulfonamide
N,N-diethyl-4-[(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)amino]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E679-0846 |
| Compound Name: | N,N-diethyl-4-[(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)amino]benzene-1-sulfonamide |
| Molecular Weight: | 414.53 |
| Molecular Formula: | C20 H26 N6 O2 S |
| Smiles: | CCN(CC)S(c1ccc(cc1)Nc1c2c(ncn1)n1CCCCCc1n2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0597 |
| logD: | 3.0594 |
| logSw: | -3.4695 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.859 |
| InChI Key: | PZRGADXIEJZQOW-UHFFFAOYSA-N |