diethyl 5-[2-(adamantan-1-yl)acetamido]-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 5-[2-(adamantan-1-yl)acetamido]-3-methylthiophene-2,4-dicarboxylate
diethyl 5-[2-(adamantan-1-yl)acetamido]-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | Y500-7946 |
| Compound Name: | diethyl 5-[2-(adamantan-1-yl)acetamido]-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 433.57 |
| Molecular Formula: | C23 H31 N O5 S |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(CC12CC3CC(CC(C3)C2)C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1736 |
| logD: | 2.6379 |
| logSw: | -5.1849 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.451 |
| InChI Key: | DTLAOKQZWWIRTJ-UHFFFAOYSA-N |