3-{4-[3-(4-chlorophenoxy)propoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
3-{4-[3-(4-chlorophenoxy)propoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
3-{4-[3-(4-chlorophenoxy)propoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0373 |
| Compound Name: | 3-{4-[3-(4-chlorophenoxy)propoxy]phenyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 437.88 |
| Molecular Formula: | C23 H20 Cl N3 O4 |
| Smiles: | Cc1cc(NC(C(=C/c2ccc(cc2)OCCCOc2ccc(cc2)[Cl])\C#N)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.62 |
| logD: | 4.1 |
| logSw: | -6.45 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 165.5 |
| InChI Key: | GRBMFGBLSMFNBI-UHFFFAOYSA-N |