Basic information
- CAS
132576-21-7- Standard SMILES
COc1ccc(-c2c(C)nn(-c3ccccc3)c2N)cc1OC- InChIKey
YCDJFCDTUAIDAA-UHFFFAOYSA-N- Molecular formula
- C18H19N3O2
- Average molar mass
- 309.4 g/mol
- Monoisotopic mass
- 309.14772686
Names & identifiers
- Preferred name
- 1H-Pyrazol-5-amine, 4-(3,4-dimethoxyphenyl)-3-methyl-1-phenyl-
- IUPAC
- 4-(3,4-dimethoxyphenyl)-3-methyl-1-phenylpyrazol-5-amine
Names & synonyms
132576-21-71H-Pyrazol-5-amine, 4-(3,4-dimethoxyphenyl)-3-methyl-1-phenyl-DTXSID70350483RefChem:239750DTXCID103015504-(3,4-dimethoxyphenyl)-3-methyl-1-phenyl-1H-pyrazol-5-amine4-(3,4-Dimethoxy-phenyl)-5-methyl-2-phenyl-2H-pyrazol-3-ylamineSMR000116161CBMicro_035017Cambridge id 5849240Oprea1_017025Oprea1_805178
Show more names
MLS000525687MLS002535831CHEMBL1489072HMS2474D21AKOS000629829ST080222BIM-0034926.P0014-(3,4-dimethoxyphenyl)-3-methyl-1-phenylpyrazole-5-ylamine
Database identifiers
- CAS
132576-21-7- PubChem CID
- 680669
- DTXSID
DTXSID70350483- ChEMBL
CHEMBL1489072- Nikkaji
- J1.510.966A
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 62.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 375
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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