ethyl 4-[(2-{[(3,4-dimethoxyphenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(2-{[(3,4-dimethoxyphenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate
ethyl 4-[(2-{[(3,4-dimethoxyphenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | K801-0378 |
| Compound Name: | ethyl 4-[(2-{[(3,4-dimethoxyphenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate |
| Molecular Weight: | 494.61 |
| Molecular Formula: | C27 H30 N2 O5 S |
| Smiles: | CCOC(c1ccc(cc1)NC(c1c2CCCCc2sc1NCc1ccc(c(c1)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4786 |
| logD: | 5.4784 |
| logSw: | -5.4978 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.294 |
| InChI Key: | SXGQUUSDSQRMNB-UHFFFAOYSA-N |