2-cyano-3-[5-(2,5-dichlorophenyl)furan-2-yl]-N-(2-methoxy-5-nitrophenyl)prop-2-enamide
Chemical Structure Depiction of
2-cyano-3-[5-(2,5-dichlorophenyl)furan-2-yl]-N-(2-methoxy-5-nitrophenyl)prop-2-enamide
2-cyano-3-[5-(2,5-dichlorophenyl)furan-2-yl]-N-(2-methoxy-5-nitrophenyl)prop-2-enamide
Compound characteristics
Compound ID: | 3681-3924 |
Compound Name: | 2-cyano-3-[5-(2,5-dichlorophenyl)furan-2-yl]-N-(2-methoxy-5-nitrophenyl)prop-2-enamide |
Molecular Weight: | 458.26 |
Molecular Formula: | C21 H13 Cl2 N3 O5 |
Smiles: | COc1ccc(cc1NC(C(=C\c1ccc(c2cc(ccc2[Cl])[Cl])o1)\C#N)=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 5.6376 |
logD: | 4.0761 |
logSw: | -6.0277 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 88.27 |
InChI Key: | DPNKJKPFOBYXKR-UHFFFAOYSA-N |