ethyl 3'-(4-nitrophenyl)-2,4-diphenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Chemical Structure Depiction of
ethyl 3'-(4-nitrophenyl)-2,4-diphenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
ethyl 3'-(4-nitrophenyl)-2,4-diphenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Compound characteristics
| Compound ID: | 8002-4864 |
| Compound Name: | ethyl 3'-(4-nitrophenyl)-2,4-diphenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate |
| Molecular Weight: | 549.61 |
| Molecular Formula: | C30 H23 N5 O4 S |
| Smiles: | CCOC(C1=NN(c2ccc(cc2)[N+]([O-])=O)C2(c3ccccc3C(c3ccccc3)=NN2c2ccccc2)S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.897 |
| logD: | 6.8936 |
| logSw: | -5.8072 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.415 |
| InChI Key: | FBCJMHLREVBCDN-SSEXGKCCSA-N |