2-({[1-(4-bromophenyl)ethylidene]amino}oxy)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Chemical Structure Depiction of
2-({[1-(4-bromophenyl)ethylidene]amino}oxy)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
2-({[1-(4-bromophenyl)ethylidene]amino}oxy)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Compound characteristics
| Compound ID: | 3235-0123 |
| Compound Name: | 2-({[1-(4-bromophenyl)ethylidene]amino}oxy)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide |
| Molecular Weight: | 432.34 |
| Molecular Formula: | C19 H18 Br N3 O2 S |
| Smiles: | C\C(c1ccc(cc1)[Br])=N/OCC(Nc1c(C#N)c2CCCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1828 |
| logD: | 4.3603 |
| logSw: | -5.0276 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.087 |
| InChI Key: | JMNDCCQINHAKTC-UHFFFAOYSA-N |