ethyl 5-(4-chlorobutanamido)-4-oxo-3-phenyl-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-chlorobutanamido)-4-oxo-3-phenyl-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate
ethyl 5-(4-chlorobutanamido)-4-oxo-3-phenyl-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate
Compound characteristics
| Compound ID: | C480-0023 |
| Compound Name: | ethyl 5-(4-chlorobutanamido)-4-oxo-3-phenyl-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate |
| Molecular Weight: | 419.89 |
| Molecular Formula: | C19 H18 Cl N3 O4 S |
| Smiles: | CCOC(C1c2csc(c2C(N(c2ccccc2)N=1)=O)NC(CCC[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7666 |
| logD: | 2.729 |
| logSw: | -3.5128 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.745 |
| InChI Key: | VEQLLKCBNUFNFR-UHFFFAOYSA-N |