2-[({3,5-dibromo-4-[(4-methylphenyl)methoxy]phenyl}methylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Chemical Structure Depiction of
2-[({3,5-dibromo-4-[(4-methylphenyl)methoxy]phenyl}methylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
2-[({3,5-dibromo-4-[(4-methylphenyl)methoxy]phenyl}methylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Compound characteristics
| Compound ID: | 8008-2703 |
| Compound Name: | 2-[({3,5-dibromo-4-[(4-methylphenyl)methoxy]phenyl}methylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile |
| Molecular Weight: | 544.31 |
| Molecular Formula: | C24 H20 Br2 N2 O S |
| Smiles: | Cc1ccc(COc2c(cc(/C=N/c3c(C#N)c4CCCCc4s3)cc2[Br])[Br])cc1 |
| Stereo: | ACHIRAL |
| logP: | 7.4309 |
| logD: | 7.4309 |
| logSw: | -5.8546 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 32.538 |
| InChI Key: | TXNGBJKWOSYTQC-UHFFFAOYSA-N |