6-bromo-N-[2-(1H-indol-3-yl)ethyl]-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-N-[2-(1H-indol-3-yl)ethyl]-2H-1-benzopyran-3-carboxamide
6-bromo-N-[2-(1H-indol-3-yl)ethyl]-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | G669-1176 |
| Compound Name: | 6-bromo-N-[2-(1H-indol-3-yl)ethyl]-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 397.27 |
| Molecular Formula: | C20 H17 Br N2 O2 |
| Smiles: | C(CNC(C1COc2ccc(cc2C=1)[Br])=O)c1c[nH]c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.2405 |
| logD: | 4.2405 |
| logSw: | -4.4024 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.734 |
| InChI Key: | VSCJPPNUXZIHDZ-UHFFFAOYSA-N |