N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-methyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-methyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-methyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | P168-0272 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-methyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide |
| Molecular Weight: | 309.32 |
| Molecular Formula: | C17 H15 N3 O3 |
| Smiles: | Cn1cc(C(NCc2ccc3c(c2)OCO3)=O)c2cccnc12 |
| Stereo: | ACHIRAL |
| logP: | 2.1054 |
| logD: | 2.1054 |
| logSw: | -2.9802 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.233 |
| InChI Key: | QBASGVYNCUVAHE-UHFFFAOYSA-N |