3-(2-ethoxyphenyl)-1-(4-methylbenzoyl)-5-(4-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Chemical Structure Depiction of
3-(2-ethoxyphenyl)-1-(4-methylbenzoyl)-5-(4-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
3-(2-ethoxyphenyl)-1-(4-methylbenzoyl)-5-(4-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Compound characteristics
Compound ID: | C171-0489 |
Compound Name: | 3-(2-ethoxyphenyl)-1-(4-methylbenzoyl)-5-(4-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione |
Molecular Weight: | 469.54 |
Molecular Formula: | C28 H27 N3 O4 |
Smiles: | CCOc1ccccc1C1C2C(C(N(C2=O)c2ccc(C)cc2)=O)N(C(c2ccc(C)cc2)=O)N1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.947 |
logD: | 3.9465 |
logSw: | -4.172 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.391 |
InChI Key: | JUTFWUOXFLXWJB-UHFFFAOYSA-N |