Basic information
- CAS
192718-06-2- Standard SMILES
O=C1c2ccccc2C(=O)c2oc(-c3ccc(F)cc3)nc21- InChIKey
ULJDFEYQOPCCPM-UHFFFAOYSA-N- Molecular formula
- C17H8FNO3
- Average molar mass
- 293.25 g/mol
- Monoisotopic mass
- 293.04882128
Names & identifiers
- Preferred name
- 2-(4-Fluorophenyl)naphtho[2,3-d]oxazole-4,9-dione
- IUPAC
- 2-(4-fluorophenyl)benzo[f][1,3]benzoxazole-4,9-dione
- English name
- 2-(4-Fluorophenyl)naphtho[2,3-d]oxazole-4,9-dione
- Molecular formula
- C17H8FNO3
- Molecular weight
- 293.25
Names & synonyms
c527192718-06-22-(4-Fluorophenyl)naphtho[2,3-d]oxazole-4,9-dioneMFCD010335402-(4-fluorophenyl)benzo[f][1,3]benzoxazole-4,9-dioneCHEMBL34075012-(4-Fluorophenyl)-naphth[2,3-d]oxazole-4,9-dione2-(4-fluorophenyl)-4H,9H-naphtho[2,3-d][1,3]oxazole-4,9-dioneEN300-17988316Z567725272-(4-fluoro-phenyl)-naphtho[2,3-d]oxazole-4,9-dioneC17H8FNO3
Show more names
C527 >=98% (HPLC)2-(4-Fluorophenyl)phtho[2,3-d]oxazole-4,9-dioneNaphth[2,3-d]oxazole-4,9-dione, 2-(4-fluorophenyl)-Inhibitor,C 527,DUBs,C527,Deubiquitinase,C-527,inhibit
Enamine_000419Oprea1_334255orb1218540orb1308505SCHEMBL7815859SCHEMBL31276578ULJDFEYQOPCCPM-UHFFFAOYSA-NGLXC-04101
Database identifiers
- CAS
192718-06-2- PubChem CID
- 2307331
- ChEMBL
CHEMBL3407501- EC Number
- 808-533-8
- Nikkaji
- J3.353.494I
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 475
Physicochemical properties
- Boiling point
- 488.6 · 488.6±47.0 °C(Predicted)
- Density
- 1.433 · 1.433±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- 0.3 mg/mL, · DMSO: soluble0.3mg/mL, clear (warmed)
- pka
- -4.21 · -4.21±0.20(Predicted)
- form
- powder
- color
- faint yellow to dark yellow
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
- Safety Statements
- 46 · 46
- WGK Germany
- 3 · 3
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 46
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
UsesC527 is a is a pan DUB enzyme inhibitor, with a high potency for the USP1/UAF1 complex (IC50=0.88 μM).
Suppliers39 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
河南闰霖化工有限公司+86-18738066252; +86-18738066252 · [email protected]
Aladdin Scientific[email protected]
上海波以尔化工有限公司[email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
銳迪國際科技有限公司18024082417 · [email protected]
上海梅凯科技有限公司021-68689288 15300790979 · [email protected]
韶关市启程生物科技有限公司18122215013 · [email protected]
郑州格然林医药科技有限公司0371-85513397 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海技毅生物科技有限公司13621943973 · [email protected]
杭州六可生物科技有限公司+86-571-86912261 19975279805 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
风咏生物（AbMole）021-10000000 13000000000 · [email protected]
BOC Sciences16314854226 · [email protected]
药渡经纬信息科技(北京)有限公司+86-400-851-9921 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海珀法姆医药科技有限公司+86 18721201413 · [email protected]
上海芮晖化工科技有限公司021-31433387 15618786686 · [email protected]
西安莱茵生物科技有限公司86-(0)29-85992781 17792393971 · [email protected]
Novachemistry44-20819178-90 02081917890 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
上海玉函化工有限公司021-61469567 13774476675 · [email protected]
上海凯裕医药科技有限公司17317130613 · [email protected]
浙江泽天精细化工有限公司18957127338 · [email protected]
郑州格然林科技有限公司0371-85513397 +86-18610099868 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
ChemeGen 中国18818260767 · [email protected]
西安科展生物科技有限公司18729005399 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
上海安毕达生物科技有限公司021-61629020 18201956406 · [email protected]
浙江天酶生物工程有限公司19967302939 · [email protected]
上海弘渠生物医药科技有限公司88888888888 · [email protected]
河南威梯希化工科技有限公司0371-55135753 18003832934 · [email protected]
Related reactions
1 records
Compound notes
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