N-{2-[(2-methylpropyl)sulfanyl]-1,3-benzothiazol-6-yl}quinoline-8-sulfonamide
Chemical Structure Depiction of
N-{2-[(2-methylpropyl)sulfanyl]-1,3-benzothiazol-6-yl}quinoline-8-sulfonamide
N-{2-[(2-methylpropyl)sulfanyl]-1,3-benzothiazol-6-yl}quinoline-8-sulfonamide
Compound characteristics
| Compound ID: | M070-1172 |
| Compound Name: | N-{2-[(2-methylpropyl)sulfanyl]-1,3-benzothiazol-6-yl}quinoline-8-sulfonamide |
| Molecular Weight: | 429.58 |
| Molecular Formula: | C20 H19 N3 O2 S3 |
| Smiles: | CC(C)CSc1nc2ccc(cc2s1)NS(c1cccc2cccnc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.055 |
| logD: | 4.477 |
| logSw: | -4.9904 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.503 |
| InChI Key: | CSBJBKMINZXDFB-UHFFFAOYSA-N |