Basic information
- CAS
133033-93-9- Standard SMILES
NC(=O)C(c1ccccc1)(c1ccccc1)C1CCN(CCc2ccc3c(c2)CCO3)C1- InChIKey
HXGBXQDTNZMWGS-UHFFFAOYSA-N- Molecular formula
- C28H30N2O2
- Average molar mass
- 426.5 g/mol
- Monoisotopic mass
- 426.2307282
Names & identifiers
- Preferred name
- (+-)-Darifenacin
- IUPAC
- 2-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide
- English name
- (±)-Darifenacin
- Molecular formula
- C28H30N2O2
- Molecular weight
- 426.56
Names & synonyms
133033-93-9DTXSID50861320(+-)-DarifenacinRefChem:1049031DTXCID70197173(+/-)-DarifenacinDarifenacin-d42-(1-(2-(2,3-dihydrobenzofuran-5-yl)ethyl)pyrrolidin-3-yl)-2,2-diphenylacetamide( inverted exclamation markA)-Darifenacin(R)-DarifenacinC28H30N2O2Darifenacin-d5
Show more names
(±)-UK-88525(±)-Darifenacin(±) Darifenacin,(±)Darifenacin3-Pyrrolidineacetamide, 1-[2-(2,3-dihydro-5-benzofuranyl)ethyl]-α,α-diphenyl-
2-(1-(2-(2,3-Dihydrobenzofuran-5-yl)ethyl)-pyrrolidin-3-yl)-2,2-diphenylacetamide1095598-84-72-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide2-{1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl}-2,2-diphenylacetamideUK-88525 (hydrobromide)(A+/-)-DarifenacinSCHEMBL113331orb1708703
Database identifiers
- CAS
133033-93-9- PubChem CID
- 72054
- DTXSID
DTXSID50861320
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 607
Experimental & physicochemical properties
DrugsPharmaceuticals
Physicochemical properties
- Boiling point
- 614.3 · 614.3±55.0 °C(Predicted)
- Density
- 1.192 · 1.192±0.06 g/cm3(Predicted)
- pka
- 15.7 · 15.70±0.50(Predicted)
- form
- Solid
- color
- White to off-white
Chemistry & industry
Applications
Uses(±)-Darifenacin is the racemate of Darifenacin. Darifenacin is a selective M3 muscarinic receptor antagonist[1].
Suppliers11 total
Aladdin Scientific[email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
成都圣美凯生物科技有限公司028-85157043 15882256948 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
ChemeGen 中国18818260767 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
Related reactions
3 records
Compound notes
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