Basic information
- CAS
1874-41-5- Standard SMILES
COc1cccc(-c2nnc(-c3ccccc3)o2)c1- InChIKey
OJJKBDBWNZRBFI-UHFFFAOYSA-N- Molecular formula
- C15H12N2O2
- Average molar mass
- 252.27 g/mol
- Monoisotopic mass
- 252.08987763
Names & identifiers
- Preferred name
- 2-(3-Methoxyphenyl)-5-phenyl-1,3,4-oxadiazole
- IUPAC
- 2-(3-methoxyphenyl)-5-phenyl-1,3,4-oxadiazole
- English name
- 2-(3-methoxyphenyl)-5-phenyl-1,3,4-oxadiazole
- Molecular formula
- C15H12N2O2
- Molecular weight
- 252.26798
Names & synonyms
2-(3-Methoxyphenyl)-5-phenyl-1,3,4-oxadiazole1874-41-5TG95CQ2TWGNSC-90370NSC-90372NSC90370EINECS 217-500-1UNII-TG95CQ2TWGCambridge id 5718595TimTec1_000600SCHEMBL3250240DTXSID60172050
Show more names
OJJKBDBWNZRBFI-UHFFFAOYSA-NBDBM192665HMS1535L06NSC90372NSC 90370NSC 90372AKOS000678099ST007921
Database identifiers
- CAS
1874-41-5- PubChem CID
- 74642
- DTXSID
DTXSID60172050- UNII
- TG95CQ2TWG
- EC Number
- 217-500-1
- Nikkaji
- J199.687H
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 48.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 281
Physicochemical properties
- FDA UNII
- 95 CQ2TWG · TG95CQ2TWG
Chemistry & industry
Suppliers1 total
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…