3-(4-chloro-3-nitrophenyl)-2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-oxopropanenitrile
Chemical Structure Depiction of
3-(4-chloro-3-nitrophenyl)-2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-oxopropanenitrile
3-(4-chloro-3-nitrophenyl)-2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-oxopropanenitrile
Compound characteristics
| Compound ID: | Y020-5405 |
| Compound Name: | 3-(4-chloro-3-nitrophenyl)-2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-oxopropanenitrile |
| Molecular Weight: | 340.72 |
| Molecular Formula: | C16 H9 Cl N4 O3 |
| Smiles: | C(C(=C1Nc2ccccc2N1)C(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)#N |
| Stereo: | ACHIRAL |
| logP: | 3.3366 |
| logD: | 3.3366 |
| logSw: | -3.9054 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.16 |
| InChI Key: | ADEYKCXWLKYLGW-UHFFFAOYSA-N |