methyl 3-(2-{5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}hydrazinyl)thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-(2-{5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}hydrazinyl)thiophene-2-carboxylate
methyl 3-(2-{5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}hydrazinyl)thiophene-2-carboxylate
Compound characteristics
| Compound ID: | K078-0047 |
| Compound Name: | methyl 3-(2-{5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}hydrazinyl)thiophene-2-carboxylate |
| Molecular Weight: | 484.37 |
| Molecular Formula: | C22 H18 Br N3 O3 S |
| Smiles: | Cc1ccc(CN2C(C(\c3cc(ccc23)[Br])=N/Nc2ccsc2C(=O)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.1598 |
| logD: | 6.1594 |
| logSw: | -5.4635 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.905 |
| InChI Key: | UXQZVQYJISGZSS-UHFFFAOYSA-N |