methyl 5-(4-chlorophenyl)-2-[(3-methyl-4-oxo-3,4-dihydrophthalazine-1-carbonyl)amino]-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-(4-chlorophenyl)-2-[(3-methyl-4-oxo-3,4-dihydrophthalazine-1-carbonyl)amino]-1,3-thiazole-4-carboxylate
methyl 5-(4-chlorophenyl)-2-[(3-methyl-4-oxo-3,4-dihydrophthalazine-1-carbonyl)amino]-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y043-5274 |
| Compound Name: | methyl 5-(4-chlorophenyl)-2-[(3-methyl-4-oxo-3,4-dihydrophthalazine-1-carbonyl)amino]-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 454.89 |
| Molecular Formula: | C21 H15 Cl N4 O4 S |
| Smiles: | CN1C(c2ccccc2C(C(Nc2nc(C(=O)OC)c(c3ccc(cc3)[Cl])s2)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9264 |
| logD: | 3.8192 |
| logSw: | -4.5446 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.228 |
| InChI Key: | NKIVIEWYIPQPCK-UHFFFAOYSA-N |