1-(4-bromophenyl)-2-[(6-{[(2-chloro-6-fluorophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(4-bromophenyl)-2-[(6-{[(2-chloro-6-fluorophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one
1-(4-bromophenyl)-2-[(6-{[(2-chloro-6-fluorophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 8004-9876 |
| Compound Name: | 1-(4-bromophenyl)-2-[(6-{[(2-chloro-6-fluorophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 519.84 |
| Molecular Formula: | C22 H13 Br Cl F N2 O S2 |
| Smiles: | C(C(c1ccc(cc1)[Br])=O)Sc1nc2ccc(cc2s1)/N=C/c1c(cccc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 6.8453 |
| logD: | 6.8452 |
| logSw: | -6.5985 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 30.4227 |
| InChI Key: | NEDLMNQNOGVGTP-UHFFFAOYSA-N |