4-chloro-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]benzamide
Chemical Structure Depiction of
4-chloro-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]benzamide
4-chloro-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V010-0597 |
| Compound Name: | 4-chloro-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]benzamide |
| Molecular Weight: | 555.07 |
| Molecular Formula: | C30 H35 Cl N2 O6 |
| Smiles: | Cc1ccc(CN(CCc2ccc(c(c2)OC)OC)C(CN(CC2CCCO2)C(c2ccc(cc2)[Cl])=O)=O)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7773 |
| logD: | 3.7773 |
| logSw: | -4.3856 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.018 |
| InChI Key: | LYJUBHHBCFWNKF-RUZDIDTESA-N |