2-cyano-3-{4-[2-(3-methoxyphenoxy)ethoxy]phenyl}-N~1~-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-{4-[2-(3-methoxyphenoxy)ethoxy]phenyl}-N~1~-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-{4-[2-(3-methoxyphenoxy)ethoxy]phenyl}-N~1~-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | 4272-0255 |
| Compound Name: | 2-cyano-3-{4-[2-(3-methoxyphenoxy)ethoxy]phenyl}-N~1~-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 512.59 |
| Molecular Formula: | C28 H24 N4 O4 S |
| Smiles: | Cc1ccccc1c1nnc(NC(C(=C/c2ccc(cc2)OCCOc2cccc(c2)OC)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.11 |
| logD: | 6.1 |
| logSw: | -7.16 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 174.38 |
| InChI Key: | IKQHGEMFJPSXMQ-UHFFFAOYSA-N |