6-bromo-N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-2H-1-benzopyran-3-carboxamide
6-bromo-N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | G669-1334 |
| Compound Name: | 6-bromo-N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 456.38 |
| Molecular Formula: | C23 H26 Br N3 O2 |
| Smiles: | CCN1CCN(CC1)Cc1ccc(cc1)NC(C1COc2ccc(cc2C=1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8586 |
| logD: | 2.9269 |
| logSw: | -3.8802 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.969 |
| InChI Key: | VXDYGIKZDFZPNM-UHFFFAOYSA-N |