Basic information
- CAS
577763-86-1- Standard SMILES
COc1ccc(C2c3c(C)n[nH]c3C(=O)N2c2ccc(C)cc2)cc1OC- InChIKey
LEGHUQUONTUALA-UHFFFAOYSA-N- Molecular formula
- C21H21N3O3
- Average molar mass
- 363.4 g/mol
- Monoisotopic mass
- 363.15829154
Names & identifiers
- Preferred name
- 4-(3,4-Dimethoxyphenyl)-3-methyl-5-(4-methylphenyl)-2,4-dihydropyrrolo[3,4-c]pyrazol-6-one
- IUPAC
- 4-(3,4-dimethoxyphenyl)-3-methyl-5-(4-methylphenyl)-2,4-dihydropyrrolo[3,4-c]pyrazol-6-one
- English name
- 4-(3,4-dimethoxyphenyl)-3-methyl-5-(4-methylphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
- Molecular formula
- C21H21N3O3
- Molecular weight
- 363.41
Names & synonyms
577763-86-14-(3,4-dimethoxyphenyl)-3-methyl-5-(4-methylphenyl)-2,4-dihydropyrrolo[3,4-c]pyrazol-6-one4-(3,4-dimethoxyphenyl)-3-methyl-5-(4-methylphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-oneSCHEMBL10117034STL062146AKOS001791101AKOS022042399AQ-149/425797644-(3,4-dimethoxyphenyl)-3-methyl-5-(p-tolyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-onePyrrolo[3,4-c]pyrazol-6(1H)-one, 4-(3,4-dimethoxyphenyl)-4,5-dihydro-3-methyl-5-(4-methylphenyl)-
Database identifiers
- CAS
577763-86-1- PubChem CID
- 3718070
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 67.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 537
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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