N,N-diethyl-1-{2-[(2-ethylphenyl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide
Chemical Structure Depiction of
N,N-diethyl-1-{2-[(2-ethylphenyl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide
N,N-diethyl-1-{2-[(2-ethylphenyl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide
Compound characteristics
| Compound ID: | L447-0254 |
| Compound Name: | N,N-diethyl-1-{2-[(2-ethylphenyl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C21 H28 N6 O3 S |
| Smiles: | CCc1ccccc1NC(NCCn1c2ccc(cc2nn1)S(N(CC)CC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7871 |
| logD: | 2.7871 |
| logSw: | -3.3772 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.78 |
| InChI Key: | UIZZVLGPOVRLBO-UHFFFAOYSA-N |