N-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
N-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
N-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Compound characteristics
| Compound ID: | D715-1447 |
| Compound Name: | N-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide |
| Molecular Weight: | 424.91 |
| Molecular Formula: | C21 H17 Cl N4 O2 S |
| Smiles: | C(C(NCc1ccccc1[Cl])=O)NC(c1ccc2c(c1)sc(n2)n1cccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8422 |
| logD: | 4.8422 |
| logSw: | -5.0697 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.645 |
| InChI Key: | LKOULETZWXXHQK-UHFFFAOYSA-N |