N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide--hydrogen chloride (1/1)
N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E677-1471 |
| Compound Name: | N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 468.4 |
| Molecular Formula: | C21 H22 Cl N3 O3 S |
| Salt: | HCl |
| Smiles: | CN(C)CCCN(C(c1ccc2c(c1)OCCO2)=O)c1nc2c(cccc2s1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2351 |
| logD: | 1.0873 |
| logSw: | -3.6201 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.834 |
| InChI Key: | ORENCYIVSKFASH-UHFFFAOYSA-N |