1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propan-1-one
Chemical Structure Depiction of
1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propan-1-one
1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propan-1-one
Compound characteristics
| Compound ID: | K953-0689 |
| Compound Name: | 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propan-1-one |
| Molecular Weight: | 395.52 |
| Molecular Formula: | C22 H25 N3 O2 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(CCN1C(Oc2ccccc12)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2411 |
| logD: | 4.2411 |
| logSw: | -4.3001 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 29.205 |
| InChI Key: | FFOPUSWRCVQLPT-UHFFFAOYSA-N |