4-benzoyl-N-[2-(dimethylamino)ethyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)benzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-benzoyl-N-[2-(dimethylamino)ethyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)benzamide--hydrogen chloride (1/1)
4-benzoyl-N-[2-(dimethylamino)ethyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)benzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E676-1039 |
| Compound Name: | 4-benzoyl-N-[2-(dimethylamino)ethyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)benzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 496.03 |
| Molecular Formula: | C26 H25 N3 O3 S |
| Salt: | HCl |
| Smiles: | CN(C)CCN(C(c1ccc(cc1)C(c1ccccc1)=O)=O)c1nc2c(cccc2s1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.8507 |
| logD: | 4.6057 |
| logSw: | -4.6763 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.108 |
| InChI Key: | PJXQTEWYVSKGKD-UHFFFAOYSA-N |