5-bromo-N-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-oxopropyl)furan-2-carboxamide
Chemical Structure Depiction of
5-bromo-N-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-oxopropyl)furan-2-carboxamide
5-bromo-N-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-oxopropyl)furan-2-carboxamide
Compound characteristics
Compound ID: | K694-0161 |
Compound Name: | 5-bromo-N-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-oxopropyl)furan-2-carboxamide |
Molecular Weight: | 425.28 |
Molecular Formula: | C18 H21 Br N2 O5 |
Smiles: | COc1ccc(CCNC(CCNC(c2ccc(o2)[Br])=O)=O)cc1OC |
Stereo: | ACHIRAL |
logP: | 1.0926 |
logD: | 1.0926 |
logSw: | -2.1254 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.993 |
InChI Key: | XGGXVVTWILUGBM-UHFFFAOYSA-N |