N-(2-oxo-2-{[(pyridin-2-yl)methyl]amino}ethyl)-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
N-(2-oxo-2-{[(pyridin-2-yl)methyl]amino}ethyl)-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
N-(2-oxo-2-{[(pyridin-2-yl)methyl]amino}ethyl)-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Compound characteristics
Compound ID: | D715-1438 |
Compound Name: | N-(2-oxo-2-{[(pyridin-2-yl)methyl]amino}ethyl)-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide |
Molecular Weight: | 391.45 |
Molecular Formula: | C20 H17 N5 O2 S |
Smiles: | C(C(NCc1ccccn1)=O)NC(c1ccc2c(c1)sc(n2)n1cccc1)=O |
Stereo: | ACHIRAL |
logP: | 3.1504 |
logD: | 3.1494 |
logSw: | -3.4463 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.188 |
InChI Key: | QSXCDBRURAKKGS-UHFFFAOYSA-N |