3-({5-[(2-chloro-6-methylphenoxy)methyl]furan-2-yl}methylidene)-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
Chemical Structure Depiction of
3-({5-[(2-chloro-6-methylphenoxy)methyl]furan-2-yl}methylidene)-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
3-({5-[(2-chloro-6-methylphenoxy)methyl]furan-2-yl}methylidene)-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
Compound characteristics
| Compound ID: | 8017-5735 |
| Compound Name: | 3-({5-[(2-chloro-6-methylphenoxy)methyl]furan-2-yl}methylidene)-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole |
| Molecular Weight: | 596.01 |
| Molecular Formula: | C28 H22 Cl N3 O8 S |
| Smiles: | Cc1ccc(cc1)S(N1CC(=C/c2ccc(COc3c(C)cccc3[Cl])o2)\c2c(cc(cc12)[N+]([O-])=O)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0483 |
| logD: | 7.0483 |
| logSw: | -6.7466 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 112.293 |
| InChI Key: | MOWSNXIQAJCAJF-UHFFFAOYSA-N |