2-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
2-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0418 |
| Compound Name: | 2-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 387.46 |
| Molecular Formula: | C19 H21 N3 O4 S |
| Smiles: | CCn1cc(C)c(C(O)=O)c1CC(Nc1nc2ccc(cc2s1)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4317 |
| logD: | 1.6325 |
| logSw: | -3.6578 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.145 |
| InChI Key: | XJDQZTFHNSPDJD-UHFFFAOYSA-N |