N-(4-acetylphenyl)-2-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-2-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
N-(4-acetylphenyl)-2-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Compound characteristics
| Compound ID: | Y041-3158 |
| Compound Name: | N-(4-acetylphenyl)-2-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C22 H19 N3 O2 S |
| Smiles: | CC(c1ccc(cc1)NC(c1ccc2c(c1)sc(n2)n1c(C)ccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.311 |
| logD: | 4.3048 |
| logSw: | -4.304 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.581 |
| InChI Key: | HATZITRYJXNABV-UHFFFAOYSA-N |