HX 630 - ≥98%(HPLC) , CAS No.188844-52-2

CAS: 188844-52-2 Cat. No.: H286706 Molecular Weight: 441.58
AVAILABLE TO ORDER
GRADE & PURITY ≥98%(HPLC)
Synonyms
AKOS024457869 | BDBM50061618 | NCGC00370944-01 | HX 630 | HY-108520 | FT-0669247 | HX630 | HX-630 | 4-(7,7,10,10-Tetramethyl-7,8,9,10-tetrahydro-5-thia-13-aza-benzo[4,5]cyclohepta[1,2-b]naphthalen-12-yl)-benzoic acid | 4-(7,8,9,10-Tetrahydro-7,7,10,10-tet
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
10mg
H286706-10mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$537.90
50mg
H286706-50mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$2,142.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
AKOS024457869 | BDBM50061618 | NCGC00370944-01 | HX 630 | HY-108520 | FT-0669247 | HX630 | HX-630 | 4-(7, 7, 10, 10-Tetramethyl-7, 8, 9, 10-tetrahydro-5-thia-13-aza-benzo[4, 5]cyclohepta[1, 2-b]naphthalen-12-yl)-benzoic acid | 4-(7, 8, 9, 10-Tetrahydro-7, 7, 10, 10-tet
Specifications & Purity
≥98%(HPLC)
Biochemical and Physiological Mechanisms
RXR agonist. Acts as a retinoid synergist; enhances the potency of AM 80 in a HL-60 cell differentiation assay.
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type
AGONIST
Purity
≥98%(HPLC)
Names and Identifiers
Canonical SmilesCC1(CCC(C2=C1C=C3C(=C2)SC4=CC=CC=C4N=C3C5=CC=C(C=C5)C(=O)O)(C)C)C
IUPAC Name4-(7,7,10,10-tetramethyl-8,9-dihydronaphtho[2,3-b][1,5]benzothiazepin-12-yl)benzoic acid
InChIKeyPFGCWQPTOKPRRK-UHFFFAOYSA-N
INCHI1S/C28H27NO2S/c1-27(2)13-14-28(3,4)21-16-24-19(15-20(21)27)25(17-9-11-18(12-10-17)26(30)31)29-22-7-5-6-8-23(22)32-24/h5-12,15-16H,13-14H2,1-4H3,(H,30,31)
Isomeric SMILES CC1(CCC(C2=C1C=C3C(=C2)SC4=CC=CC=C4N=C3C5=CC=C(C=C5)C(=O)O)(C)C)C
Molecular Weight 441.58
Reaxy-Rn 7891093
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7891093&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassBenzothiazepines
SubclassDibenzothiazepines
Intermediate Tree Nodes Not available
Direct ParentDibenzothiazepines
Alternative Parents Diarylthioethers  Tetralins  Benzoic acids  Benzoyl derivatives  Ketimines  Propargyl-type 1,3-dipolar organic compounds  Carboxylic acids  Azacyclic compounds  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Dibenzothiazepine - Diarylthioether - Tetralin - Benzoic acid or derivatives - Benzoic acid - Aryl thioether - Benzoyl - Monocyclic benzene moiety - Benzenoid - Ketimine - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Organic oxygen compound - Organic nitrogen compound - Imine - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as dibenzothiazepines. These are compounds containing a dibenzothiazepine moiety, which consists of two benzene connected by a thiazepine ring.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
RARA Tclin Retinoic acid receptor alpha (1324 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
RXRG Tclin Retinoid X receptor gamma (646 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
RARB Tclin Retinoic acid receptor beta (1232 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
RXRA Tclin Retinoid X receptor alpha (3637 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
RXRB Tclin Retinoid X receptor beta (726 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
SolubilitySolvent:DMSO, Max Conc. mg/mL: 22.08, Max Conc. mM: 50
Molecular Weight441.600 g/mol
XLogP37.800
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass441.176 Da
Monoisotopic Mass441.176 Da
Topological Polar Surface Area75.000 Ų
Heavy Atom Count32
Formal Charge0
Complexity751.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
Reviews

Customer Reviews

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