5-[4-(4-chloro-2-methylphenoxy)butanamido]-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide
Chemical Structure Depiction of
5-[4-(4-chloro-2-methylphenoxy)butanamido]-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide
5-[4-(4-chloro-2-methylphenoxy)butanamido]-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y204-0635 |
| Compound Name: | 5-[4-(4-chloro-2-methylphenoxy)butanamido]-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide |
| Molecular Weight: | 447.98 |
| Molecular Formula: | C22 H26 Cl N3 O3 S |
| Smiles: | CCN(CC)C(c1c(C)c(C#N)c(NC(CCCOc2ccc(cc2C)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5052 |
| logD: | 3.7267 |
| logSw: | -4.8301 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.403 |
| InChI Key: | BRNBNKFRTAOWHU-UHFFFAOYSA-N |