propan-2-yl 2-{[4-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenoxy]sulfonyl}benzoate
Chemical Structure Depiction of
propan-2-yl 2-{[4-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenoxy]sulfonyl}benzoate
propan-2-yl 2-{[4-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenoxy]sulfonyl}benzoate
Compound characteristics
| Compound ID: | V029-4524 |
| Compound Name: | propan-2-yl 2-{[4-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenoxy]sulfonyl}benzoate |
| Molecular Weight: | 528.62 |
| Molecular Formula: | C27 H32 N2 O7 S |
| Smiles: | CC(C)OC(c1ccccc1S(=O)(=O)Oc1ccc(CN(Cc2ccco2)C(NC(C)(C)C)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9285 |
| logD: | 4.9285 |
| logSw: | -4.5246 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.359 |
| InChI Key: | BWORABDHJROTBA-UHFFFAOYSA-N |