AVE3085 - Moligand™,≥99% , CAS No.450348-85-3

CAS: 450348-85-3 Cat. No.: A649013 분자식: C17H13F2NO3 분자량: 317.29 PubChem CID: 3510704
주문 가능
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥99%
Synonyms
AKOS040741187 | Z2273249951 | UNII-GWD67BMF7L | MS-24681 | 1,3-BENZODIOXOLE-5-CARBOXAMIDE, N-(2,3-DIHYDRO-1H-INDEN-2-YL)-2,2-DIFLUORO- | AVE3085 | AVE-3085 | AVE 3085 | SCHEMBL611278 | AB00019844-01 | OKCJNSDIVCXYAL-UHFFFAOYSA-N | GWD67BMF7L | 1,3-Bezodio
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
★
Size
USA
독일 (EU)*
Price
Qty
1mg
A649013-1mg
주문제작 · 8~12주
US$180.90
5mg
A649013-5mg
주문제작 · 8~12주
US$360.90
10mg
A649013-10mg
주문제작 · 8~12주
US$580.90
25mg
A649013-25mg
주문제작 · 8~12주
US$449.90
50mg
A649013-50mg
주문제작 · 8~12주
US$1,840.90
100mg
A649013-100mg
주문제작 · 8~12주
US$2,940.90
250mg
A649013-250mg
주문제작 · 8~12주
US$1,349.90
Enter a quantity for the sizes you want to add.
🧪

Why this grade

Moligand™,≥99% Moligand™ 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

동의어
AKOS040741187 | Z2273249951 | UNII-GWD67BMF7L | MS-24681 | 1,3-BENZODIOXOLE-5-CARBOXAMIDE, N-(2,3-DIHYDRO-1H-INDEN-2-YL)-2,2-DIFLUORO- | AVE3085 | AVE-3085 | AVE 3085 | SCHEMBL611278 | AB00019844-01 | OKCJNSDIVCXYAL-UHFFFAOYSA-N | GWD67BMF7L | 1,3-Bezodio
사양 및 순도
Moligand™,≥99%
생화학 및 생리적 메커니즘
AVE3085 is a potent endothelial nitric oxide synthase enhancer, used for cardiovascular disease treatment.
보관 조건
Store at -20°C
배송
Ice chest + Ice pads
이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.
등급
Moligand™
작업 유형
ACTIVATOR
순수함
≥99%
이름과 식별자
정식 스마일C1C(CC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)OC(O4)(F)F
IUPAC NameN-(2,3-dihydro-1H-inden-2-yl)-2,2-difluoro-1,3-benzodioxole-5-carboxamide
InChIKeyOKCJNSDIVCXYAL-UHFFFAOYSA-N
INCHI1S/C17H13F2NO3/c18-17(19)22-14-6-5-12(9-15(14)23-17)16(21)20-13-7-10-3-1-2-4-11(10)8-13/h1-6,9,13H,7-8H2,(H,20,21)
이성체 SMILES C1C(CC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)OC(O4)(F)F
대체 CAS 450348-85-3
PubChem CID 3510704
MeSH 용어 2,2-difluorobenzo(1,3)dioxole-5-carboxylic acid indan-2-ylamide;AVE 3085;AVE-3085;AVE3085
분자량 317.29

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
분류Benzodioxoles
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentBenzodioxoles
Alternative Parents Indanes  Secondary carboxylic acid amides  Oxacyclic compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organofluorides  Organic oxides  Hydrocarbon derivatives  Alkyl fluorides  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Benzodioxole - Indane - Benzenoid - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Oxacycle - Organic oxide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organopnictogen compound - Alkyl fluoride - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - Aromatic heteropolycyclic compound
설명This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors Not available
3D 구조
상호 작용 화학 구조 모델





인증서(CoA, COO, BSE/TSE 및 분석 차트)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot NumberCertificate Type날짜항목
I2618307Certificate of AnalysisApr 29, 2026 A649013
I2618308Certificate of AnalysisApr 29, 2026 A649013
I2618309Certificate of AnalysisApr 29, 2026 A649013
I2618310Certificate of AnalysisApr 29, 2026 A649013
I2618311Certificate of AnalysisApr 29, 2026 A649013
I2618312Certificate of AnalysisApr 29, 2026 A649013
화학 및 물리적 특성
용해성DMSO : 250 mg/mL (787.92 mM; Need ultrasonic)
분자량317.290 g/mol
XLogP33.800
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass317.086 Da
Monoisotopic Mass317.086 Da
Topological Polar Surface Area47.600 Ų
Heavy Atom Count23
Formal Charge0
Complexity459.000
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
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리뷰

고객 리뷰

자주 묻는 질문

What are the CAS number, molecular formula and molecular weight?
The CAS Number is 450348-85-3, the molecular formula is C17H13F2NO3, and the molecular weight is 317.29 g/mol. InChIKey OKCJNSDIVCXYAL-UHFFFAOYSA-N.

Need help choosing the grade?

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View Moligand™ grade guide →

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