butyl 2-{[4-({(furan-2-carbonyl)[(oxolan-2-yl)methyl]amino}methyl)phenoxy]sulfonyl}benzoate
Chemical Structure Depiction of
butyl 2-{[4-({(furan-2-carbonyl)[(oxolan-2-yl)methyl]amino}methyl)phenoxy]sulfonyl}benzoate
butyl 2-{[4-({(furan-2-carbonyl)[(oxolan-2-yl)methyl]amino}methyl)phenoxy]sulfonyl}benzoate
Compound characteristics
| Compound ID: | V030-3310 |
| Compound Name: | butyl 2-{[4-({(furan-2-carbonyl)[(oxolan-2-yl)methyl]amino}methyl)phenoxy]sulfonyl}benzoate |
| Molecular Weight: | 541.62 |
| Molecular Formula: | C28 H31 N O8 S |
| Smiles: | CCCCOC(c1ccccc1S(=O)(=O)Oc1ccc(CN(CC2CCCO2)C(c2ccco2)=O)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2383 |
| logD: | 4.2383 |
| logSw: | -4.2288 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 90.22 |
| InChI Key: | MERLOUHORISHRM-HSZRJFAPSA-N |