3-{[5-(4-bromophenyl)furan-2-yl]methylidene}-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
Chemical Structure Depiction of
3-{[5-(4-bromophenyl)furan-2-yl]methylidene}-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
3-{[5-(4-bromophenyl)furan-2-yl]methylidene}-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
Compound characteristics
| Compound ID: | 8017-6107 |
| Compound Name: | 3-{[5-(4-bromophenyl)furan-2-yl]methylidene}-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole |
| Molecular Weight: | 596.41 |
| Molecular Formula: | C26 H18 Br N3 O7 S |
| Smiles: | Cc1ccc(cc1)S(N1CC(=C/c2ccc(c3ccc(cc3)[Br])o2)\c2c(cc(cc12)[N+]([O-])=O)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0268 |
| logD: | 7.0268 |
| logSw: | -5.8198 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 105.451 |
| InChI Key: | OWHWVXIYSBYUIV-UHFFFAOYSA-N |