2-({6-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)-N-benzylacetamide
Chemical Structure Depiction of
2-({6-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)-N-benzylacetamide
2-({6-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)-N-benzylacetamide
Compound characteristics
| Compound ID: | D478-0042 |
| Compound Name: | 2-({6-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)-N-benzylacetamide |
| Molecular Weight: | 492.57 |
| Molecular Formula: | C24 H20 N4 O4 S2 |
| Smiles: | C(c1ccccc1)NC(CSc1nc2ccc(cc2s1)NC(Nc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3046 |
| logD: | 5.3046 |
| logSw: | -5.6022 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.938 |
| InChI Key: | QMYKBSKANNZDNV-UHFFFAOYSA-N |