2-({[5-(2,3-dimethyl-4-nitrophenyl)furan-2-yl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Chemical Structure Depiction of
2-({[5-(2,3-dimethyl-4-nitrophenyl)furan-2-yl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
2-({[5-(2,3-dimethyl-4-nitrophenyl)furan-2-yl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Compound characteristics
| Compound ID: | 8009-2968 |
| Compound Name: | 2-({[5-(2,3-dimethyl-4-nitrophenyl)furan-2-yl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile |
| Molecular Weight: | 405.47 |
| Molecular Formula: | C22 H19 N3 O3 S |
| Smiles: | Cc1c(ccc(c1C)[N+]([O-])=O)c1ccc(/C=N/c2c(C#N)c3CCCCc3s2)o1 |
| Stereo: | ACHIRAL |
| logP: | 6.0823 |
| logD: | 6.0823 |
| logSw: | -5.6407 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.787 |
| InChI Key: | MFPMDDPHTPLZAA-UHFFFAOYSA-N |