methyl 4-chloro-2-{[2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 4-chloro-2-{[2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]carbamamido}benzoate
methyl 4-chloro-2-{[2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | M509-0046 |
| Compound Name: | methyl 4-chloro-2-{[2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]carbamamido}benzoate |
| Molecular Weight: | 400.86 |
| Molecular Formula: | C20 H21 Cl N4 O3 |
| Smiles: | CCn1cc(CCNC(Nc2cc(ccc2C(=O)OC)[Cl])=O)c2cccnc12 |
| Stereo: | ACHIRAL |
| logP: | 2.974 |
| logD: | 2.7414 |
| logSw: | -3.4987 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.816 |
| InChI Key: | YZNLLHOSYMWBOD-UHFFFAOYSA-N |