2,3,5,6-tetramethyl-N-{4-oxo-3-[(1H-1,2,4-triazol-3-yl)sulfanyl]naphthalen-1(4H)-ylidene}benzene-1-sulfonamide
Chemical Structure Depiction of
2,3,5,6-tetramethyl-N-{4-oxo-3-[(1H-1,2,4-triazol-3-yl)sulfanyl]naphthalen-1(4H)-ylidene}benzene-1-sulfonamide
2,3,5,6-tetramethyl-N-{4-oxo-3-[(1H-1,2,4-triazol-3-yl)sulfanyl]naphthalen-1(4H)-ylidene}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 7202-2020 |
| Compound Name: | 2,3,5,6-tetramethyl-N-{4-oxo-3-[(1H-1,2,4-triazol-3-yl)sulfanyl]naphthalen-1(4H)-ylidene}benzene-1-sulfonamide |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C22 H20 N4 O3 S2 |
| Smiles: | Cc1cc(C)c(C)c(c1C)S(/N=C1/C=C(C(c2ccccc12)=O)Sc1nc[nH]n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.496 |
| logD: | 4.4934 |
| logSw: | -4.4215 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.41 |
| InChI Key: | QUWPZVAYLJFTJY-UHFFFAOYSA-N |