3-{2-[(1,3-thiazol-2-yl)sulfamoyl]-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridin-6-yl}benzoic acid
Chemical Structure Depiction of
3-{2-[(1,3-thiazol-2-yl)sulfamoyl]-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridin-6-yl}benzoic acid
3-{2-[(1,3-thiazol-2-yl)sulfamoyl]-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridin-6-yl}benzoic acid
Compound characteristics
| Compound ID: | 8017-2862 |
| Compound Name: | 3-{2-[(1,3-thiazol-2-yl)sulfamoyl]-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridin-6-yl}benzoic acid |
| Molecular Weight: | 481.59 |
| Molecular Formula: | C24 H23 N3 O4 S2 |
| Smiles: | C1CC2CC1C1C2c2cc(ccc2NC1c1cccc(c1)C(O)=O)S(Nc1nccs1)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6858 |
| logD: | 1.3244 |
| logSw: | -4.5959 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.144 |
| InChI Key: | DORMNIVSDNEPEU-UHFFFAOYSA-N |