methyl 3'-(4-bromophenyl)-4-methyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Chemical Structure Depiction of
methyl 3'-(4-bromophenyl)-4-methyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
methyl 3'-(4-bromophenyl)-4-methyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Compound characteristics
| Compound ID: | 8012-6831 |
| Compound Name: | methyl 3'-(4-bromophenyl)-4-methyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate |
| Molecular Weight: | 507.41 |
| Molecular Formula: | C24 H19 Br N4 O2 S |
| Smiles: | CC1c2ccccc2C2(N(c3ccccc3)N=1)N(c1ccc(cc1)[Br])N=C(C(=O)OC)S2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2776 |
| logD: | 6.2775 |
| logSw: | -5.6599 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.898 |
| InChI Key: | NOLSQSYJLUQARQ-XMMPIXPASA-N |