N-(6-chloro-1,3-benzothiazol-2-yl)-2-{1-[(3,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}-2-oxoacetamide
Chemical Structure Depiction of
N-(6-chloro-1,3-benzothiazol-2-yl)-2-{1-[(3,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}-2-oxoacetamide
N-(6-chloro-1,3-benzothiazol-2-yl)-2-{1-[(3,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}-2-oxoacetamide
Compound characteristics
| Compound ID: | L793-4791 |
| Compound Name: | N-(6-chloro-1,3-benzothiazol-2-yl)-2-{1-[(3,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}-2-oxoacetamide |
| Molecular Weight: | 423.92 |
| Molecular Formula: | C22 H18 Cl N3 O2 S |
| Smiles: | Cc1ccc(Cn2cccc2C(C(Nc2nc3ccc(cc3s2)[Cl])=O)=O)cc1C |
| Stereo: | ACHIRAL |
| logP: | 6.3943 |
| logD: | 6.3632 |
| logSw: | -6.2264 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.419 |
| InChI Key: | ABUKIIBBPAIHJH-UHFFFAOYSA-N |