methyl 4-methyl-3'-(2-nitrophenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Chemical Structure Depiction of
methyl 4-methyl-3'-(2-nitrophenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
methyl 4-methyl-3'-(2-nitrophenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Compound characteristics
Compound ID: | 8012-8670 |
Compound Name: | methyl 4-methyl-3'-(2-nitrophenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate |
Molecular Weight: | 473.51 |
Molecular Formula: | C24 H19 N5 O4 S |
Smiles: | CC1c2ccccc2C2(N(c3ccccc3)N=1)N(c1ccccc1[N+]([O-])=O)N=C(C(=O)OC)S2 |
Stereo: | RACEMIC MIXTURE |
logP: | 5.2921 |
logD: | 5.292 |
logSw: | -5.3887 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 78.678 |
InChI Key: | ZGLUFXJSEQDEAI-XMMPIXPASA-N |