1-[3'-(3-chlorophenyl)-4-(4-ethylphenyl)-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-chlorophenyl)-4-(4-ethylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethan-1-one
1-[3'-(3-chlorophenyl)-4-(4-ethylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8007-4229 |
| Compound Name: | 1-[3'-(3-chlorophenyl)-4-(4-ethylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethan-1-one |
| Molecular Weight: | 537.08 |
| Molecular Formula: | C31 H25 Cl N4 O S |
| Smiles: | CCc1ccc(cc1)C1c2ccccc2C2(N(c3ccccc3)N=1)N(c1cccc(c1)[Cl])N=C(C(C)=O)S2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.05 |
| logD: | 8.0019 |
| logSw: | -6.2799 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.106 |
| InChI Key: | RVBQWNLGJVGKPV-WJOKGBTCSA-N |