di(propan-2-yl) 5-({5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
di(propan-2-yl) 5-({5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-3-methylthiophene-2,4-dicarboxylate
di(propan-2-yl) 5-({5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | Y500-5304 |
| Compound Name: | di(propan-2-yl) 5-({5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 566.47 |
| Molecular Formula: | C24 H28 Br N3 O6 S |
| Smiles: | CC(C)OC(c1c(C)c(C(=O)OC(C)C)sc1NC(c1ccc(Cn2c(C)c(c(C)n2)[Br])o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8856 |
| logD: | 2.0598 |
| logSw: | -4.6782 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.113 |
| InChI Key: | SWGUEPVROJOYDJ-UHFFFAOYSA-N |