ethyl 2-[4-(3-methylbutoxy)benzamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[4-(3-methylbutoxy)benzamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
ethyl 2-[4-(3-methylbutoxy)benzamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3379-1017 |
| Compound Name: | ethyl 2-[4-(3-methylbutoxy)benzamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate |
| Molecular Weight: | 429.58 |
| Molecular Formula: | C24 H31 N O4 S |
| Smiles: | CCOC(c1c2CCCCCc2sc1NC(c1ccc(cc1)OCCC(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3378 |
| logD: | 3.0068 |
| logSw: | -5.4887 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.547 |
| InChI Key: | MTYQPIOQTIIVIZ-UHFFFAOYSA-N |