N-[(3-chloro-4-fluorophenyl)methyl]-2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-[(3-chloro-4-fluorophenyl)methyl]-2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazole-4-carboxamide
N-[(3-chloro-4-fluorophenyl)methyl]-2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | P613-0533 |
| Compound Name: | N-[(3-chloro-4-fluorophenyl)methyl]-2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 414.89 |
| Molecular Formula: | C20 H16 Cl F N4 O S |
| Smiles: | CCn1cc(c2cccnc12)c1nc(cs1)C(NCc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.152 |
| logD: | 4.1484 |
| logSw: | -4.4429 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.021 |
| InChI Key: | KWIYPAYTTWGJFP-UHFFFAOYSA-N |