N-{4-methoxy-6-[(3-methylbutyl)carbamamido]-1,3-benzothiazol-2-yl}benzamide
Chemical Structure Depiction of
N-{4-methoxy-6-[(3-methylbutyl)carbamamido]-1,3-benzothiazol-2-yl}benzamide
N-{4-methoxy-6-[(3-methylbutyl)carbamamido]-1,3-benzothiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | F690-0844 |
| Compound Name: | N-{4-methoxy-6-[(3-methylbutyl)carbamamido]-1,3-benzothiazol-2-yl}benzamide |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C21 H24 N4 O3 S |
| Smiles: | CC(C)CCNC(Nc1cc(c2c(c1)sc(NC(c1ccccc1)=O)n2)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6068 |
| logD: | 4.6056 |
| logSw: | -4.2941 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.23 |
| InChI Key: | XXNMSQYPWQJTQQ-UHFFFAOYSA-N |