1-[3'-(4-methoxyphenyl)-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'-(4-methoxyphenyl)-4-methyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethan-1-one
1-[3'-(4-methoxyphenyl)-4-methyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethan-1-one
Compound characteristics
| Compound ID: | 2490-0094 |
| Compound Name: | 1-[3'-(4-methoxyphenyl)-4-methyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethan-1-one |
| Molecular Weight: | 442.54 |
| Molecular Formula: | C25 H22 N4 O2 S |
| Smiles: | CC1c2ccccc2C2(N(c3ccccc3)N=1)N(c1ccc(cc1)OC)N=C(C(C)=O)S2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2468 |
| logD: | 5.2466 |
| logSw: | -5.1409 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.095 |
| InChI Key: | UUIYECPGXONYIZ-RUZDIDTESA-N |