N-[1-(adamantan-1-yl)ethyl]-5-{[(4-methylphenyl)methanesulfinyl]methyl}furan-2-carboxamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)ethyl]-5-{[(4-methylphenyl)methanesulfinyl]methyl}furan-2-carboxamide
N-[1-(adamantan-1-yl)ethyl]-5-{[(4-methylphenyl)methanesulfinyl]methyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | C799-0339 |
| Compound Name: | N-[1-(adamantan-1-yl)ethyl]-5-{[(4-methylphenyl)methanesulfinyl]methyl}furan-2-carboxamide |
| Molecular Weight: | 439.62 |
| Molecular Formula: | C26 H33 N O3 S |
| Smiles: | CC(C12CC3CC(CC(C3)C2)C1)NC(c1ccc(CS(Cc2ccc(C)cc2)=O)o1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9317 |
| logD: | 4.9317 |
| logSw: | -4.6272 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.462 |
| InChI Key: | MKFNRAYFLLOISD-UHFFFAOYSA-N |