3-(5-bromo-1H-indol-3-yl)-3-oxopropanenitrile
Chemical Structure Depiction of
3-(5-bromo-1H-indol-3-yl)-3-oxopropanenitrile
3-(5-bromo-1H-indol-3-yl)-3-oxopropanenitrile
Compound characteristics
| Compound ID: | Y040-9426 |
| Compound Name: | 3-(5-bromo-1H-indol-3-yl)-3-oxopropanenitrile |
| Molecular Weight: | 263.09 |
| Molecular Formula: | C11 H7 Br N2 O |
| Smiles: | C(C#N)C(c1c[nH]c2ccc(cc12)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3224 |
| logD: | 0.6961 |
| logSw: | -3.0494 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.848 |
| InChI Key: | JNOHABODURGTQE-UHFFFAOYSA-N |