3-{[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl}-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-{[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl}-1,3-benzothiazol-2(3H)-one
3-{[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl}-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | D080-0056 |
| Compound Name: | 3-{[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl}-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 343.79 |
| Molecular Formula: | C16 H10 Cl N3 O2 S |
| Smiles: | C(c1nnc(c2ccccc2[Cl])o1)N1C(=O)Sc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.476 |
| logD: | 3.476 |
| logSw: | -3.874 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.993 |
| InChI Key: | CBPXQDJBQOKPHH-UHFFFAOYSA-N |