ethyl 5-(3,3-dimethylbutanamido)-4-oxo-3-phenyl-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate
Chemical Structure Depiction of
ethyl 5-(3,3-dimethylbutanamido)-4-oxo-3-phenyl-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate
ethyl 5-(3,3-dimethylbutanamido)-4-oxo-3-phenyl-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate
Compound characteristics
| Compound ID: | C480-0008 |
| Compound Name: | ethyl 5-(3,3-dimethylbutanamido)-4-oxo-3-phenyl-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate |
| Molecular Weight: | 413.49 |
| Molecular Formula: | C21 H23 N3 O4 S |
| Smiles: | CCOC(C1c2csc(c2C(N(c2ccccc2)N=1)=O)NC(CC(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8277 |
| logD: | 3.7404 |
| logSw: | -4.0824 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.745 |
| InChI Key: | YWOYWXOOAYHPMJ-UHFFFAOYSA-N |