4-{[(2-amino-1,2-dicyanoethenyl)imino]methyl}phenyl 4-(4-pentylcyclohexyl)benzoate
Chemical Structure Depiction of
4-{[(2-amino-1,2-dicyanoethenyl)imino]methyl}phenyl 4-(4-pentylcyclohexyl)benzoate
4-{[(2-amino-1,2-dicyanoethenyl)imino]methyl}phenyl 4-(4-pentylcyclohexyl)benzoate
Compound characteristics
| Compound ID: | 8007-9363 |
| Compound Name: | 4-{[(2-amino-1,2-dicyanoethenyl)imino]methyl}phenyl 4-(4-pentylcyclohexyl)benzoate |
| Molecular Weight: | 468.6 |
| Molecular Formula: | C29 H32 N4 O2 |
| Smiles: | CCCCCC1CCC(CC1)c1ccc(cc1)C(=O)Oc1ccc(/C=N/C(\C#N)=C(\C#N)N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.9988 |
| logD: | 6.9987 |
| logSw: | -5.7523 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.515 |
| InChI Key: | KUMQUJJOVAFTFJ-UHFFFAOYSA-N |