ethyl 4-[(2-{[(2,4,5-trimethoxyphenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(2-{[(2,4,5-trimethoxyphenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate
ethyl 4-[(2-{[(2,4,5-trimethoxyphenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | K801-0376 |
| Compound Name: | ethyl 4-[(2-{[(2,4,5-trimethoxyphenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate |
| Molecular Weight: | 524.64 |
| Molecular Formula: | C28 H32 N2 O6 S |
| Smiles: | CCOC(c1ccc(cc1)NC(c1c2CCCCc2sc1NCc1cc(c(cc1OC)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7112 |
| logD: | 5.711 |
| logSw: | -5.4674 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.924 |
| InChI Key: | KGAOTJZLJGIZPB-UHFFFAOYSA-N |