Basic information
- CAS
37795-69-0- Standard SMILES
O=c1c2ccccc2nc2n1OCC2- InChIKey
ZHIKRYZUZNUZFQ-UHFFFAOYSA-N- Molecular formula
- C10H8N2O2
- Average molar mass
- 188.18 g/mol
- Monoisotopic mass
- 188.0585775
Overview
structure
Names & identifiers
- Preferred name
- 2,3-Dihydro-9H-isoxazolo(3,2-b)quinazolin-9-one
- IUPAC
- 2,3-dihydro-[1,2]oxazolo[3,2-b]quinazolin-9-one
- English name
- 2,3-DIHYDRO-ISOXAZOLO[3,2B]QUINAZOLIN-9-ONE
- Molecular formula
- C10H8N2O2
- Molecular weight
- 188.18
Names & synonyms
W-242937795-69-02,3-Dihydro-9H-isoxazolo(3,2-b)quinazolin-9-one9H-ISOXAZOLO(3,2-b)QUINAZOLIN-9-ONE, 2,3-DIHYDRO-NSC-2948366152QM1944DTXSID001912402,3-dihydro-9h-isoxazolo[3,2-b]quinazolin-9-oneRefChem:81719DTXCID101137312,3-dihydro-[1,2]oxazolo[3,2-b]quinazolin-9-one2,3-DIHYDRO-ISOXAZOLO[3,2B]QUINAZOLIN-9-ONE
Show more names
W 2429,W24299H-Isoxazolo[3,2-b]quinazolin-9-one, 2,3-dihydro-
NSC2948369H-Isoxazolo(3, 2,3-dihydro-9H-Isoxazolo[3, 2,3-dihydro-NSC 294836BRN 1076660UNII-6152QM19442,3-Dihydro-9H-isoxazolo(3,2-b)chinazolin-9-on [German]2,2-b)quinazolin-9-one
Database identifiers
- CAS
37795-69-0- PubChem CID
- 37835
- DTXSID
DTXSID00191240- UNII
- 6152QM1944
- Nikkaji
- J53.660A
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 300
Physicochemical properties
- Boiling point
- 323.18 °C · 323.18°C (rough estimate)
- Density
- 1.2577 · 1.2577 (rough estimate)
- refractive index
- 1.591 · 1.5910 (estimate)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- Soluble in DMSO
- FDA UNII
- 6152 QM1944 · 6152QM1944
Chemistry & industry
Applications
UsesW-2429 (NSC294836) is considerably more effective than acetylsalicylic acid in inhibiting carrageenan-induced edema and in reducing brewer's yeast-induced fever in rats[2].
Suppliers5 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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