4-(1H-benzotriazol-1-yl)-5-(2,6-dichlorophenoxy)benzene-1,2-dicarbonitrile
Chemical Structure Depiction of
4-(1H-benzotriazol-1-yl)-5-(2,6-dichlorophenoxy)benzene-1,2-dicarbonitrile
4-(1H-benzotriazol-1-yl)-5-(2,6-dichlorophenoxy)benzene-1,2-dicarbonitrile
Compound characteristics
| Compound ID: | 8016-4115 |
| Compound Name: | 4-(1H-benzotriazol-1-yl)-5-(2,6-dichlorophenoxy)benzene-1,2-dicarbonitrile |
| Molecular Weight: | 406.23 |
| Molecular Formula: | C20 H9 Cl2 N5 O |
| Smiles: | C(c1cc(c(cc1C#N)Oc1c(cccc1[Cl])[Cl])n1c2ccccc2nn1)#N |
| Stereo: | ACHIRAL |
| logP: | 4.7935 |
| logD: | 4.7935 |
| logSw: | -5.1026 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 66.62 |
| InChI Key: | VYGDCMJCQZUTHG-UHFFFAOYSA-N |