methyl 4-[(5-{[(benzenesulfonyl)amino]methyl}furan-2-yl)methylidene]-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(5-{[(benzenesulfonyl)amino]methyl}furan-2-yl)methylidene]-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(5-{[(benzenesulfonyl)amino]methyl}furan-2-yl)methylidene]-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4983-0199 |
| Compound Name: | methyl 4-[(5-{[(benzenesulfonyl)amino]methyl}furan-2-yl)methylidene]-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 474.53 |
| Molecular Formula: | C23 H26 N2 O7 S |
| Smiles: | CC1=C(/C(=C\c2ccc(CNS(c3ccccc3)(=O)=O)o2)C(N1CCCOC)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.7019 |
| logD: | 2.7015 |
| logSw: | -3.077 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.473 |
| InChI Key: | IOVUNPXCGSXPBX-UHFFFAOYSA-N |