ethyl 4-[(6-methyl-2-{[(5-methylfuran-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(6-methyl-2-{[(5-methylfuran-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate
ethyl 4-[(6-methyl-2-{[(5-methylfuran-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | K801-0540 |
| Compound Name: | ethyl 4-[(6-methyl-2-{[(5-methylfuran-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]benzoate |
| Molecular Weight: | 452.57 |
| Molecular Formula: | C25 H28 N2 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NC(c1c2CCC(C)Cc2sc1NCc1ccc(C)o1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3552 |
| logD: | 6.3549 |
| logSw: | -5.6577 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.296 |
| InChI Key: | ZBLFYVMQAZJSSD-OAHLLOKOSA-N |