ethyl 4-{[2-(1-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazole-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[2-(1-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazole-4-carbonyl]amino}benzoate
ethyl 4-{[2-(1-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazole-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | P613-0222 |
| Compound Name: | ethyl 4-{[2-(1-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazole-4-carbonyl]amino}benzoate |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C21 H18 N4 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(c1csc(c2cn(C)c3c2cccn3)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1004 |
| logD: | 4.096 |
| logSw: | -4.0164 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.283 |
| InChI Key: | QINKXOWNOCYAIC-UHFFFAOYSA-N |