2-cyano-3-{1-[2-(3-methoxyphenoxy)ethyl]-1H-pyrrol-2-yl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{1-[2-(3-methoxyphenoxy)ethyl]-1H-pyrrol-2-yl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
2-cyano-3-{1-[2-(3-methoxyphenoxy)ethyl]-1H-pyrrol-2-yl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0930 |
| Compound Name: | 2-cyano-3-{1-[2-(3-methoxyphenoxy)ethyl]-1H-pyrrol-2-yl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 392.41 |
| Molecular Formula: | C21 H20 N4 O4 |
| Smiles: | Cc1cc(NC(C(=C/c2cccn2CCOc2cccc(c2)OC)\C#N)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.06 |
| logD: | 3.21 |
| logSw: | -4.62 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 170.16 |
| InChI Key: | FHPWCISMVZNCMO-UHFFFAOYSA-N |