N-[3-cyano-4-(4-methoxyphenyl)-5-methylthiophen-2-yl]butanamide
Chemical Structure Depiction of
N-[3-cyano-4-(4-methoxyphenyl)-5-methylthiophen-2-yl]butanamide
N-[3-cyano-4-(4-methoxyphenyl)-5-methylthiophen-2-yl]butanamide
Compound characteristics
| Compound ID: | Y205-4106 |
| Compound Name: | N-[3-cyano-4-(4-methoxyphenyl)-5-methylthiophen-2-yl]butanamide |
| Molecular Weight: | 314.4 |
| Molecular Formula: | C17 H18 N2 O2 S |
| Smiles: | CCCC(Nc1c(C#N)c(c2ccc(cc2)OC)c(C)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9028 |
| logD: | 3.879 |
| logSw: | -4.2549 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.511 |
| InChI Key: | XZMKDJHRXVZVHQ-UHFFFAOYSA-N |