N-butyl-5-{[(4-methylphenyl)methanesulfinyl]methyl}furan-2-carboxamide
Chemical Structure Depiction of
N-butyl-5-{[(4-methylphenyl)methanesulfinyl]methyl}furan-2-carboxamide
N-butyl-5-{[(4-methylphenyl)methanesulfinyl]methyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | E535-5087 |
| Compound Name: | N-butyl-5-{[(4-methylphenyl)methanesulfinyl]methyl}furan-2-carboxamide |
| Molecular Weight: | 333.45 |
| Molecular Formula: | C18 H23 N O3 S |
| Smiles: | CCCCNC(c1ccc(CS(Cc2ccc(C)cc2)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.094 |
| logD: | 3.094 |
| logSw: | -3.3235 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.379 |
| InChI Key: | ZGTSOJUQTRUHEN-UHFFFAOYSA-N |