1-[3'-(3-chloro-2-methylphenyl)-4-methyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethan-1-one
Chemical Structure Depiction of
1-[3'-(3-chloro-2-methylphenyl)-4-methyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethan-1-one
1-[3'-(3-chloro-2-methylphenyl)-4-methyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethan-1-one
Compound characteristics
| Compound ID: | 1675-0075 |
| Compound Name: | 1-[3'-(3-chloro-2-methylphenyl)-4-methyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethan-1-one |
| Molecular Weight: | 460.98 |
| Molecular Formula: | C25 H21 Cl N4 O S |
| Smiles: | CC1c2ccccc2C2(N(c3ccccc3)N=1)N(c1cccc(c1C)[Cl])N=C(C(C)=O)S2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3244 |
| logD: | 6.3238 |
| logSw: | -6.0288 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.25 |
| InChI Key: | IWZDDSSTTNVURQ-RUZDIDTESA-N |