4-acetyl-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]benzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-acetyl-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]benzamide--hydrogen chloride (1/1)
4-acetyl-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]benzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E677-2700 |
| Compound Name: | 4-acetyl-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]benzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 453.94 |
| Molecular Formula: | C21 H21 F2 N3 O2 S |
| Salt: | HCl |
| Smiles: | CC(c1ccc(cc1)C(N(CCCN(C)C)c1nc2c(cc(cc2s1)F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5787 |
| logD: | 1.4309 |
| logSw: | -3.7742 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.838 |
| InChI Key: | OZAFIQBRYPPWNJ-UHFFFAOYSA-N |