Fezolamine Fumarate
Basic information
- CAS
80410-37-3- Standard SMILES
CN(C)CCCn1cc(-c2ccccc2)c(-c2ccccc2)n1.O=C(O)/C=C/C(=O)O- InChIKey
ASDTZBJQJPTXLA-WLHGVMLRSA-N- Molecular formula
- C24H27N3O4
- Average molar mass
- 421.5 g/mol
- Monoisotopic mass
- 421.20015635
Overview
See also: Fezolamine (has active moiety).
Names & identifiers
- Preferred name
- Fezolamine Fumarate
- IUPAC
- (E)-but-2-enedioic acid;3-(3,4-diphenylpyrazol-1-yl)-N,N-dimethylpropan-1-amine
Names & synonyms
FEZOLAMINE FUMARATE80410-37-3I1GX0BGV7PWin-41528-2WIN 41528-2WIN-41,528-2RefChem:140360Fezolamine fumarate [USAN]Fezolamine fumarate (USAN)1H-Pyrazole-1-propanamine, N,N-dimethyl-3,4-diphenyl-, (E)-2-butenedioate (1:1)UNII-I1GX0BGV7P1-(3-(Dimethylamino)propyl)-3,4-diphenylpyrazole fumarate (1:1)
Show more names
1-[3-(Dimethylamino)propyl]-3,4-diphenylpyrazole fumarate (1:1)SCHEMBL122598CHEMBL2105076FEZOLAMINE FUMARATE [MART.](E)-but-2-enedioic acid;3-(3,4-diphenylpyrazol-1-yl)-N,N-dimethylpropan-1-amineD04179Q272802501H-Pyrazole-1-propanamine, N,N-dimethyl-3,4-diphenyl-,
Database identifiers
- CAS
80410-37-3- PubChem CID
- 6435397
- ChEMBL
CHEMBL2105076- UNII
- I1GX0BGV7P
Properties
Computed structural properties
- Topological polar surface area
- 95.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 451
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…