propan-2-yl 2-{[4-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenoxy]sulfonyl}benzoate
Chemical Structure Depiction of
propan-2-yl 2-{[4-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenoxy]sulfonyl}benzoate
propan-2-yl 2-{[4-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenoxy]sulfonyl}benzoate
Compound characteristics
| Compound ID: | V029-4548 |
| Compound Name: | propan-2-yl 2-{[4-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenoxy]sulfonyl}benzoate |
| Molecular Weight: | 514.6 |
| Molecular Formula: | C26 H30 N2 O7 S |
| Smiles: | CC(C)NC(N(Cc1ccc(cc1)OS(c1ccccc1C(=O)OC(C)C)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4806 |
| logD: | 4.4806 |
| logSw: | -4.2748 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.51 |
| InChI Key: | CJCBYZUQWHLYLY-UHFFFAOYSA-N |