Basic information
- CAS
53602-00-9- Standard SMILES
O=c1[nH]oc2c1CNCC2- InChIKey
SXXLKZCNJHJYFL-UHFFFAOYSA-N- Molecular formula
- C6H8N2O2
- Average molar mass
- 140.14 g/mol
- Monoisotopic mass
- 140.0585775
Overview
inhibitor of GABA uptake systems; RN given refers to parent cpd
Names & identifiers
- Preferred name
- 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one
- IUPAC
- 4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-c]pyridin-3-one
- English name
- 4,5,6,7-tetrahydroisoxazolo(4,5-c)pyridin-3-ol
- Molecular formula
- C6H8N2O2
- Molecular weight
- 140.14
Names & synonyms
53602-00-94,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3-ol4,5,6,7-tetrahydroisoxazolo[4,5-c]pyridin-3(2H)-oneDTXSID902018224,5,6,7-Tetrahydroisoxazolo[4,5-c]pyridin-3-ol4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-oneRefChem:911852DTXCID201243133-hydroxy-4-amino-4,5,6,7-tetrahydro-1,2-benzisoxazoleTHPO4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-c]pyridin-3-oneCHEMBL150830
Show more names
4H,5H,6H,7H-[1,2]oxazolo[4,5-c]pyridin-3-olIsoxazolo[4,5-c]pyridin-3(2H)-one, 4,5,6,7-tetrahydro-
2H,3H,4H,5H,6H,7H-[1,2]oxazolo[4,5-c]pyridin-3-oneSXXLKZCNJHJYFL-UHFFFAOYSA-NSCHEMBL455554GTPL4727SCHEMBL1002284Isoxazolo(4,5-d)pyridin-3(2H)-one, 4,5,6,7-tetrahydro-BDBM50226145AKOS006371191
Database identifiers
- CAS
53602-00-9- PubChem CID
- 1695
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 210
Chemistry & industry
Suppliers8 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海旭晗化学科技有限公司15921303235 · [email protected]
杭州迈世腾药物科技有限公司0571-82896630 18969958410 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海智乾生物科技有限公司[email protected]
佰美济华（河南）医药科技有限公司0371-88900765 18037465274 · [email protected]
陕西西化化学工业有限公司18161915376 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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