N,N-dimethyl-4-[3-(2,3,5,6-tetramethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazole-9-carbonyl]benzene-1-sulfonamide
Chemical Structure Depiction of
N,N-dimethyl-4-[3-(2,3,5,6-tetramethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazole-9-carbonyl]benzene-1-sulfonamide
N,N-dimethyl-4-[3-(2,3,5,6-tetramethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazole-9-carbonyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 0934-1287 |
| Compound Name: | N,N-dimethyl-4-[3-(2,3,5,6-tetramethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazole-9-carbonyl]benzene-1-sulfonamide |
| Molecular Weight: | 505.6 |
| Molecular Formula: | C26 H27 N5 O4 S |
| Smiles: | Cc1cc(C)c(C)c(C2=NON3N2c2ccccc2N3C(c2ccc(cc2)S(N(C)C)(=O)=O)=O)c1C |
| Stereo: | ACHIRAL |
| logP: | 4.714 |
| logD: | 4.714 |
| logSw: | -4.589 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 82.739 |
| InChI Key: | FYSXGBFBJXMSJL-UHFFFAOYSA-N |