N-(2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
Chemical Structure Depiction of
N-(2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
N-(2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
Compound characteristics
| Compound ID: | 8009-6541 |
| Compound Name: | N-(2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide |
| Molecular Weight: | 417.52 |
| Molecular Formula: | C20 H20 F N3 O2 S2 |
| Smiles: | CC(C)(C)NC(CSc1nc2ccc(cc2s1)NC(c1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5329 |
| logD: | 4.5277 |
| logSw: | -4.3723 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.706 |
| InChI Key: | OHJWFUSJKXYMBX-UHFFFAOYSA-N |