Basic information
- CAS
21561-09-1- Standard SMILES
COc1cc2ncnc(Nc3ccccc3)c2cc1OC- InChIKey
MJKCGAHOCZLYDG-UHFFFAOYSA-N- Molecular formula
- C16H15N3O2
- Average molar mass
- 281.31 g/mol
- Monoisotopic mass
- 281.11642673
Names & identifiers
- Preferred name
- 6,7-dimethoxy-N-phenylquinazolin-4-amine
- IUPAC
- 6,7-dimethoxy-N-phenylquinazolin-4-amine
- English name
- 4-Phenylamino-6,7-dimethoxyquinazoline
- Molecular formula
- C16H15N3O2
- Molecular weight
- 281.31
Names & synonyms
6,7-dimethoxy-N-phenylquinazolin-4-amineRefChem:107360921561-09-1WHI-P2584-Phenylamino-6,7-dimethoxyquinazoline4-Quinazolinamine, 6,7-dimethoxy-N-phenyl-MFCD018152946,7-dimethoxy-N-phenyl-4-quinazolinamineCHEMBL94191Oprea1_506594BDBM3530orb1225659
Show more names
WHI-P258, 10 mM in DMSOJAK3 INHIBITOR, NEGATIVE CONTROLN-(6,7-DIMETHOXY-4-QUINAZOLINYL)-N-PHENYLAMINEJAK3 INHIBITOR NEGATIVE CONTROLWHIP258WHI P258WHI P258,WHI-P258,inhibit,Inhibitor,JNK,WHI-P-258,WHIP258
orb1306682SCHEMBL1257431SCHEMBL29515328WHI-P258?DTXSID80274409HMS1662N04EX-A1237s6521
Database identifiers
- CAS
21561-09-1- PubChem CID
- 3798
- DTXSID
DTXSID80274409- ChEMBL
CHEMBL94191- Nikkaji
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 56.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 323
Experimental & physicochemical properties
LogP3.04
Physicochemical properties
- Boiling point
- 441.2 · 441.2±40.0 °C(Predicted)
- Density
- 1 · 1+-.0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- 25 mg/ml; · DMF: 25 mg/ml; DMF:PBS(pH 7.2)(1:1): 0.5 mg/ml; DMSO: 15 mg/ml
- form
- A crystalline solid
- pka
- 6.19 · 6.19±0.70(Predicted)
- color
- White to off-white
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
DescriptionWHI-P258 is a quinazoline compound that modeling studies suggested would bind to the active site of JAK3 with an estimated Ki value of 72 μM. However, it is inactive at JAK3 (IC50 = >300 μM) and has been used as a negative control for structurally similar compounds that inhibit platelet aggregation and herpes simplex virus 1 (HSV-1) replication.
Uses4-Phenylamino-6,7-dimethoxyquinazoline is a specific inhibitors of Janus kinase 3 (JAK3).
Suppliers59 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
InvivoChem中国13549236410 · [email protected]
銳迪國際科技有限公司18024082417 · [email protected]
VDM Biochemicals0330-2528181 · [email protected]
Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…