ethyl 4-[(6-methyl-2-{[(3-methylthiophen-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(6-methyl-2-{[(3-methylthiophen-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate
ethyl 4-[(6-methyl-2-{[(3-methylthiophen-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | K801-0542 |
| Compound Name: | ethyl 4-[(6-methyl-2-{[(3-methylthiophen-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate |
| Molecular Weight: | 468.64 |
| Molecular Formula: | C25 H28 N2 O3 S2 |
| Smiles: | CCOC(c1ccc(cc1)NC(c1c2CCC(C)Cc2sc1NCc1c(C)ccs1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8054 |
| logD: | 6.8051 |
| logSw: | -5.7984 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.051 |
| InChI Key: | OYBPXFTUCINYOQ-OAHLLOKOSA-N |