2,4,6-trimethyl-N-{4-oxo-3-[(1H-1,2,4-triazol-3-yl)sulfanyl]naphthalen-1(4H)-ylidene}benzene-1-sulfonamide
Chemical Structure Depiction of
2,4,6-trimethyl-N-{4-oxo-3-[(1H-1,2,4-triazol-3-yl)sulfanyl]naphthalen-1(4H)-ylidene}benzene-1-sulfonamide
2,4,6-trimethyl-N-{4-oxo-3-[(1H-1,2,4-triazol-3-yl)sulfanyl]naphthalen-1(4H)-ylidene}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 7202-2009 |
| Compound Name: | 2,4,6-trimethyl-N-{4-oxo-3-[(1H-1,2,4-triazol-3-yl)sulfanyl]naphthalen-1(4H)-ylidene}benzene-1-sulfonamide |
| Molecular Weight: | 438.53 |
| Molecular Formula: | C21 H18 N4 O3 S2 |
| Smiles: | Cc1cc(C)c(c(C)c1)S(/N=C1/C=C(C(c2ccccc12)=O)Sc1nc[nH]n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.137 |
| logD: | 4.1344 |
| logSw: | -4.3592 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.41 |
| InChI Key: | ZTQLHGRSHMZCRJ-UHFFFAOYSA-N |