ethyl 3'-(3-chlorophenyl)-4-(4-ethylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Chemical Structure Depiction of
ethyl 3'-(3-chlorophenyl)-4-(4-ethylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
ethyl 3'-(3-chlorophenyl)-4-(4-ethylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Compound characteristics
| Compound ID: | 8006-4676 |
| Compound Name: | ethyl 3'-(3-chlorophenyl)-4-(4-ethylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate |
| Molecular Weight: | 567.11 |
| Molecular Formula: | C32 H27 Cl N4 O2 S |
| Smiles: | CCc1ccc(cc1)C1c2ccccc2C2(N(c3ccccc3)N=1)N(c1cccc(c1)[Cl])N=C(C(=O)OCC)S2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.6513 |
| logD: | 8.6373 |
| logSw: | -6.3153 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.033 |
| InChI Key: | MJMDYXQTGZHMKD-JGCGQSQUSA-N |