methyl 2-[(2-imino-8-methoxy-2H-1-benzopyran-3-carbonyl)amino]-5-propylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[(2-imino-8-methoxy-2H-1-benzopyran-3-carbonyl)amino]-5-propylthiophene-3-carboxylate
methyl 2-[(2-imino-8-methoxy-2H-1-benzopyran-3-carbonyl)amino]-5-propylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-5678 |
| Compound Name: | methyl 2-[(2-imino-8-methoxy-2H-1-benzopyran-3-carbonyl)amino]-5-propylthiophene-3-carboxylate |
| Molecular Weight: | 400.45 |
| Molecular Formula: | C20 H20 N2 O5 S |
| Smiles: | CCCc1cc(C(=O)OC)c(NC(C2=Cc3cccc(c3OC2=N)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.6142 |
| logD: | 0.446 |
| logSw: | -3.9588 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.85 |
| InChI Key: | GBVLUQGTAZITSH-UHFFFAOYSA-N |