ethyl 4-{(2-{[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)[2-(pyrrolidin-1-yl)ethyl]amino}-4-oxobutanoate
Chemical Structure Depiction of
ethyl 4-{(2-{[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)[2-(pyrrolidin-1-yl)ethyl]amino}-4-oxobutanoate
ethyl 4-{(2-{[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)[2-(pyrrolidin-1-yl)ethyl]amino}-4-oxobutanoate
Compound characteristics
| Compound ID: | V003-9706 |
| Compound Name: | ethyl 4-{(2-{[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)[2-(pyrrolidin-1-yl)ethyl]amino}-4-oxobutanoate |
| Molecular Weight: | 517.66 |
| Molecular Formula: | C27 H36 F N3 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(CCC(N(CCN1CCCC1)CC(N(Cc1ccc(cc1)F)Cc1c(C)ccs1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2174 |
| logD: | 1.5411 |
| logSw: | -3.1384 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.11 |
| InChI Key: | UPSXILGYYZFWCN-UHFFFAOYSA-N |