methyl 3-{[2-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenoxy]sulfonyl}thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{[2-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenoxy]sulfonyl}thiophene-2-carboxylate
methyl 3-{[2-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenoxy]sulfonyl}thiophene-2-carboxylate
Compound characteristics
| Compound ID: | V029-2645 |
| Compound Name: | methyl 3-{[2-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenoxy]sulfonyl}thiophene-2-carboxylate |
| Molecular Weight: | 492.57 |
| Molecular Formula: | C22 H24 N2 O7 S2 |
| Smiles: | CC(C)NC(N(Cc1ccccc1OS(c1ccsc1C(=O)OC)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.908 |
| logD: | 3.908 |
| logSw: | -4.0225 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.356 |
| InChI Key: | XRXTZIYYBMFCRM-UHFFFAOYSA-N |