N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-4-fluoro-N-[2-(pyrrolidin-1-yl)ethyl]benzamide
Chemical Structure Depiction of
N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-4-fluoro-N-[2-(pyrrolidin-1-yl)ethyl]benzamide
N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-4-fluoro-N-[2-(pyrrolidin-1-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | V013-9625 |
| Compound Name: | N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-4-fluoro-N-[2-(pyrrolidin-1-yl)ethyl]benzamide |
| Molecular Weight: | 551.66 |
| Molecular Formula: | C31 H38 F N3 O5 |
| Salt: | not_available |
| Smiles: | Cc1ccc(CN(CCc2ccc(c(c2)OC)OC)C(CN(CCN2CCCC2)C(c2ccc(cc2)F)=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.4268 |
| logD: | 2.4706 |
| logSw: | -3.5768 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.69 |
| InChI Key: | DUJUWFSIMLMPBU-UHFFFAOYSA-N |