methyl 2-[(8-methyl-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(8-methyl-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carbonyl)amino]benzoate
methyl 2-[(8-methyl-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | C593-1096 |
| Compound Name: | methyl 2-[(8-methyl-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carbonyl)amino]benzoate |
| Molecular Weight: | 393.42 |
| Molecular Formula: | C21 H15 N O5 S |
| Smiles: | Cc1ccc2c(c1)c1c(cc(C(Nc3ccccc3C(=O)OC)=O)s1)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 4.6641 |
| logD: | 4.6037 |
| logSw: | -4.5997 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.474 |
| InChI Key: | CFLIMZMKWFZLTO-UHFFFAOYSA-N |