Basic information
- CAS
569-59-5- Standard SMILES
CN1CCC2=C(C1)C(c1ccccc1)c1ccccc12.O=C(O)[C@H](O)[C@@H](O)C(=O)O- InChIKey
WFXURHIXPXVPGM-LREBCSMRSA-N- Molecular formula
- C23H25NO6
- Average molar mass
- 411.4 g/mol
- Monoisotopic mass
- 411.16818752
Overview
See also: Phenindamine (has active moiety).
Names & identifiers
- Preferred name
- Phenindamine Tartrate
- IUPAC
- (2R,3R)-2,3-dihydroxybutanedioic acid;2-methyl-9-phenyl-1,3,4,9-tetrahydroindeno[2,1-c]pyridine
- English name
- phenindamine tartrate
- Molecular formula
- C19H19N.C4H6O6
- Molecular weight
- 411.452
Names & synonyms
Phenindamine tartratePernovinePhenindamine bitartratePhenindamine hydrogen tartratePernovin569-59-528725X3PV8Thephorin tartrate1H-INDENO(2,1-c)PYRIDINE, 2,3,4,9-TETRAHYDRO-2-METHYL-9-PHENYL-, TARTRATE (1:1)NSC-915262,3,4,9-TETRAHYDRO-2-METHYL-9-PHENYL-1H-INDENO(2,1-C)PYRIDINE TARTRATERefChem:172695
Show more names
209-320-7Phenindamine tartrate [USAN]NolahistPhenindamine tartrate (USAN)Nolahist (TN)EINECS 209-320-7NSC 91526UNII-28725X3PV8
Database identifiers
- CAS
569-59-5- PubChem CID
- 11290
- ChEMBL
CHEMBL2107213- UNII
- 28725X3PV8
- EC Number
- 209-320-7
Properties
Computed structural properties
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 524
Physicochemical properties
- Melting point
- 160 ° · 160°
- solubility
- Sparingly soluble in water; slightly soluble in ethanol (96%); practically insoluble in ether .
- FDA 21 CFR
- 310.545 · 310.545; 341.12
- FDA UNII
- 28725 X3PV8 · 28725X3PV8
- Toxicity
- 50 in · LD50 in mice (mg/kg): 27 i.v., 170 i.p., 265 orally (Schallek)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- Toxicity
- LD50 in mice (mg/kg): 27 i.v., 170 i.p., 265 orally (Schallek)
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Drugs that selectively bind to but do not activate histamine H1 receptors, thereby blocking the actions of endogenous histamine. Included here are the classical antihistaminics that antagonize or prevent the action of histamine mainly in immediate hypersensitivity. They act in the bronchi, capillaries, and some other smooth muscles, and are used to prevent or allay motion sickness, seasonal rhinitis, and allergic dermatitis and to induce somnolence. The effects of blocking central nervous system H1 receptors are not as well understood.
Applications
UsesHistamine H1 receptor antagonist; antihistamine.
General DescriptionPhenindamine tartrate,2,3,4,9-tetrahydro-2-methyl-9-phenyl-1H-indeno[2, 1-c]pyridine bitartrate, occurs as a creamy-white powder, usuallywith a faint odor and sparingly soluble in water (1:40). A 2%aqueous solution has a pH of about 3.5. It is most stable inthe pH range of 3.5 to 5.0 and is unstable in solutions of pH 7or higher. Oxidizing substances or heat may cause isomerizationto an inactive form.Structurally, phenindamine can be regarded as an unsaturatedpropylamine derivative, in that the rigid ring systemcontains a distorted, trans-alkene. Like the other commonlyused antihistamines, it may produce drowsiness and sleepiness;it may also cause a mildly stimulating action in somepatients and insomnia when taken just before bedtime.
Upstream & downstream products
Upstream raw materials
Suppliers6 total
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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