methyl 2-[(8-ethoxy-2-oxo-2H-1-benzopyran-3-carbonyl)amino]-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate
Chemical Structure Depiction of
methyl 2-[(8-ethoxy-2-oxo-2H-1-benzopyran-3-carbonyl)amino]-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate
methyl 2-[(8-ethoxy-2-oxo-2H-1-benzopyran-3-carbonyl)amino]-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate
Compound characteristics
| Compound ID: | 6049-0086 |
| Compound Name: | methyl 2-[(8-ethoxy-2-oxo-2H-1-benzopyran-3-carbonyl)amino]-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate |
| Molecular Weight: | 505.55 |
| Molecular Formula: | C27 H23 N O7 S |
| Smiles: | CCOc1cccc2C=C(C(Nc3c(C(=O)OC)c4c5ccc(cc5CCc4s3)OC)=O)C(=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 5.073 |
| logD: | 3.4236 |
| logSw: | -4.788 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.307 |
| InChI Key: | OUWGZJKNTCQODL-UHFFFAOYSA-N |