N-[2-(4-methoxyanilino)-2-oxoethyl]-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
N-[2-(4-methoxyanilino)-2-oxoethyl]-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
N-[2-(4-methoxyanilino)-2-oxoethyl]-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Compound characteristics
| Compound ID: | D715-1623 |
| Compound Name: | N-[2-(4-methoxyanilino)-2-oxoethyl]-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C21 H18 N4 O3 S |
| Smiles: | COc1ccc(cc1)NC(CNC(c1ccc2c(c1)sc(n2)n1cccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2205 |
| logD: | 4.2205 |
| logSw: | -4.35 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.866 |
| InChI Key: | SPZVYSOUAZKVHN-UHFFFAOYSA-N |