1-(3-ethyl-5-methoxy-1,3-benzothiazol-2(3H)-ylidene)propan-2-one
Chemical Structure Depiction of
1-(3-ethyl-5-methoxy-1,3-benzothiazol-2(3H)-ylidene)propan-2-one
1-(3-ethyl-5-methoxy-1,3-benzothiazol-2(3H)-ylidene)propan-2-one
Compound characteristics
| Compound ID: | 1365-0041 |
| Compound Name: | 1-(3-ethyl-5-methoxy-1,3-benzothiazol-2(3H)-ylidene)propan-2-one |
| Molecular Weight: | 249.33 |
| Molecular Formula: | C13 H15 N O2 S |
| Smiles: | CCN1/C(=C\C(C)=O)Sc2ccc(cc12)OC |
| Stereo: | ACHIRAL |
| logP: | 3.2969 |
| logD: | 3.2968 |
| logSw: | -3.6729 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 22.5264 |
| InChI Key: | BGVLELSCIHASRV-UHFFFAOYSA-N |