butyl 2-{[4-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenoxy]sulfonyl}benzoate
Chemical Structure Depiction of
butyl 2-{[4-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenoxy]sulfonyl}benzoate
butyl 2-{[4-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenoxy]sulfonyl}benzoate
Compound characteristics
| Compound ID: | V030-3303 |
| Compound Name: | butyl 2-{[4-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenoxy]sulfonyl}benzoate |
| Molecular Weight: | 541.66 |
| Molecular Formula: | C29 H35 N O7 S |
| Smiles: | CCCCOC(c1ccccc1S(=O)(=O)Oc1ccc(CN(Cc2ccco2)C(CC(C)(C)C)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1402 |
| logD: | 6.1402 |
| logSw: | -5.4794 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 80.48 |
| InChI Key: | UEBVWLGJMRVGSU-UHFFFAOYSA-N |