ethyl 2-[(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 1982-0323 |
| Compound Name: | ethyl 2-[(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 387.54 |
| Molecular Formula: | C22 H29 N O3 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(C12CC3CC(CC(C3)C2)C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8259 |
| logD: | 2.6082 |
| logSw: | -5.4808 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.832 |
| InChI Key: | KFAHCXHRNCAASD-UHFFFAOYSA-N |