methyl 3-{[2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]carbamamido}thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{[2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]carbamamido}thiophene-2-carboxylate
methyl 3-{[2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]carbamamido}thiophene-2-carboxylate
Compound characteristics
| Compound ID: | M509-0074 |
| Compound Name: | methyl 3-{[2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]carbamamido}thiophene-2-carboxylate |
| Molecular Weight: | 372.44 |
| Molecular Formula: | C18 H20 N4 O3 S |
| Smiles: | CCn1cc(CCNC(Nc2ccsc2C(=O)OC)=O)c2cccnc12 |
| Stereo: | ACHIRAL |
| logP: | 2.173 |
| logD: | 2.1577 |
| logSw: | -2.6013 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.835 |
| InChI Key: | VGFKQCDOLDJUME-UHFFFAOYSA-N |