ethyl 4-[(2-{[(2,3,4-trimethoxyphenyl)methyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(2-{[(2,3,4-trimethoxyphenyl)methyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonyl)amino]benzoate
ethyl 4-[(2-{[(2,3,4-trimethoxyphenyl)methyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | K801-0681 |
| Compound Name: | ethyl 4-[(2-{[(2,3,4-trimethoxyphenyl)methyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonyl)amino]benzoate |
| Molecular Weight: | 538.66 |
| Molecular Formula: | C29 H34 N2 O6 S |
| Smiles: | CCOC(c1ccc(cc1)NC(c1c2CCCCCc2sc1NCc1ccc(c(c1OC)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4226 |
| logD: | 6.4224 |
| logSw: | -5.7579 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.428 |
| InChI Key: | RLZBCGCWKBJQRZ-UHFFFAOYSA-N |