N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[(pyridin-3-yl)methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Chemical Structure Depiction of
N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[(pyridin-3-yl)methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[(pyridin-3-yl)methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Compound characteristics
| Compound ID: | G786-0396 |
| Compound Name: | N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[(pyridin-3-yl)methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide |
| Molecular Weight: | 439.44 |
| Molecular Formula: | C22 H15 F2 N3 O3 S |
| Smiles: | C(c1cccnc1)N(C(c1ccc2c(c1)OCCO2)=O)c1nc2c(cc(cc2s1)F)F |
| Stereo: | ACHIRAL |
| logP: | 3.3775 |
| logD: | 3.3773 |
| logSw: | -3.4172 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.236 |
| InChI Key: | MHKKQANWJIUVSM-UHFFFAOYSA-N |