N,N-dipropyl-4-[3-(2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazole-9-carbonyl]benzene-1-sulfonamide
Chemical Structure Depiction of
N,N-dipropyl-4-[3-(2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazole-9-carbonyl]benzene-1-sulfonamide
N,N-dipropyl-4-[3-(2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazole-9-carbonyl]benzene-1-sulfonamide
Compound characteristics
Compound ID: | 2332-0419 |
Compound Name: | N,N-dipropyl-4-[3-(2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazole-9-carbonyl]benzene-1-sulfonamide |
Molecular Weight: | 547.68 |
Molecular Formula: | C29 H33 N5 O4 S |
Smiles: | CCCN(CCC)S(c1ccc(cc1)C(N1c2ccccc2N2C(c3c(C)cc(C)cc3C)=NON12)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.9405 |
logD: | 5.9405 |
logSw: | -5.5364 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 80.679 |
InChI Key: | UMEUKVCAVKFZIR-UHFFFAOYSA-N |