Basic information
- CAS
6326-06-3- Standard SMILES
Cc1ccc(S(=O)(=O)NC2c3ccccc3Oc3ccccc32)cc1- InChIKey
OZCQEUZTOAAWDK-UHFFFAOYSA-N- Molecular formula
- C20H17NO3S
- Average molar mass
- 351.4 g/mol
- Monoisotopic mass
- 351.09291458
Names & identifiers
- Preferred name
- 4-Methyl-N-9H-xanthen-9-yl-benzenesulfonamide
- IUPAC
- 4-methyl-N-(9H-xanthen-9-yl)benzenesulfonamide
- English name
- AH 7614
- Molecular formula
- C20H17NO3S
- Molecular weight
- 351.42
Names & synonyms
4-Methyl-N-9H-xanthen-9-yl-benzenesulfonamideRefChem:9126806326-06-34-Methyl-N-(9H-xanthen-9-yl)benzenesulfonamideAH-7614AH 76144-Methyl-N-(9H-xanthen-9-yl)-benzenesulfonamideMFCD003792734-methyl-N-(9H-xanthen-9-yl)benzene-1-sulfonamideCHEMBL3311302AH7614p-Toluenesulfonamide, N-(xanthen-9-yl)-
Show more names
AH7614 ，S9477AH-7614, 10 mM in DMSOAH-7614, FFA4/GPR120 antagonistBenzenesulfonamide, 4-methyl-N-9H-xanthen-9-yl-allosteric,linoleic,negative,FFAR,GPR120,FFA4,inhibit,AH7614,AH-7614,NAM,Inhibitor,Free Fatty Acid Receptor,acid
NSC31171ChemDiv3_003436Oprea1_006107Oprea1_382032N-xanthyl-p-toluenesulfonamideorb1217792orb1306116SCHEMBL19260836
Database identifiers
- CAS
6326-06-3- PubChem CID
- 233085
- DTXSID
DTXSID40979307- ChEMBL
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 63.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 528
Physicochemical properties
- Melting point
- 196 · 196-197 °C(Solv: ethanol (64-17-5); 1,4-dioxane (123-91-1))
- Boiling point
- 505.9 · 505.9±60.0 °C(Predicted)
- Density
- 1.37 · 1.37±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C (des.)
- solubility
- Soluble in DMSO (up to 50 mg/ml) or in Ethanol (up to 8 mg/ml with warming).
- form
- solid
- pka
- 10.33 · 10.33±0.20(Predicted)
- color
- Off-white
- Stability
- 2 years · Stable for 2 years from date of purchase as supplied. Solutions in DMSO or ethanol may be stored at -20° for up to 1 month.
- InChI
- InChI=1S/C20H17NO3S/c1-14-10-12-15(13-11-14)25(22,23)21-20-16-6-2-4-8-18(16)24-19-9-5-3-7-17(19)20/h2-13,20-21H,1H3
- InChIKey
- OZCQEUZTOAAWDK-UHFFFAOYSA-N
- SMILES
- C1(S(NC2C3=C(C=CC=C3)OC3=C2C=CC=C3)(=O)=O)=CC=C(C)C=C1
- UNSPSC Code
- 41121800 · 41121800
- NACRES
- 77 · NA.77
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- WGK 3
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Applications
DescriptionAH-7614 (6326-06-3) is a selective antagonist at free fatty acid receptor 4 (FFA4), also known as GPR120. pIC50s= 7.1 and 1.
UsesAH 7614 is a sellective FFAR4 (free fatty acid receptor 4) antagonist which inhibits the intracellular calcium accumilation induced by linoleic acid or FFAR agonists.
Suppliers41 total
上海策嵘生物科技有限公司[email protected]
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
淄博茵泰医药科技有限公司18766946537 · [email protected]
上海优宁维生物科技股份有限公司15921930842 15921930842 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Nantong HI-FUTURE Biology Co., Ltd.+86-18051384581 · [email protected]
欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]
湖北魏氏化学试剂股份有限公司17771898297 13125137661 · [email protected]
韶关市启程生物科技有限公司18122215013 · [email protected]
湖北扬信医药科技有限公司0714-3999001 19171453112 · [email protected]
Related reactions
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Compound notes
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