ethyl 2-{2-[(2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[(2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{2-[(2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y040-7155 |
| Compound Name: | ethyl 2-{2-[(2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 503.57 |
| Molecular Formula: | C28 H25 N O6 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(COc1ccc2C(=CC(=O)Oc2c1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9875 |
| logD: | 2.8057 |
| logSw: | -4.8003 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.22 |
| InChI Key: | LKPSGJHFCQVMSG-UHFFFAOYSA-N |