ethyl 4-[4-(dimethylamino)-3-{[2,2-dimethyl-N-(1-phenylethyl)propanamido]methyl}anilino]-4-oxobutanoate
Chemical Structure Depiction of
ethyl 4-[4-(dimethylamino)-3-{[2,2-dimethyl-N-(1-phenylethyl)propanamido]methyl}anilino]-4-oxobutanoate
ethyl 4-[4-(dimethylamino)-3-{[2,2-dimethyl-N-(1-phenylethyl)propanamido]methyl}anilino]-4-oxobutanoate
Compound characteristics
| Compound ID: | V028-1434 |
| Compound Name: | ethyl 4-[4-(dimethylamino)-3-{[2,2-dimethyl-N-(1-phenylethyl)propanamido]methyl}anilino]-4-oxobutanoate |
| Molecular Weight: | 481.64 |
| Molecular Formula: | C28 H39 N3 O4 |
| Salt: | not_available |
| Smiles: | CCOC(CCC(Nc1ccc(c(CN(C(C)c2ccccc2)C(C(C)(C)C)=O)c1)N(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8841 |
| logD: | 4.8823 |
| logSw: | -4.3878 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.625 |
| InChI Key: | JNYLFJWUYRBOCE-FQEVSTJZSA-N |