Basic information
- CAS
1939-53-3- Standard SMILES
O=c1cc(-c2cccnc2)oc2c1ccc1ccccc12- InChIKey
RURRJHXFMININK-UHFFFAOYSA-N- Molecular formula
- C18H11NO2
- Average molar mass
- 273.3 g/mol
- Monoisotopic mass
- 273.07897859
Names & identifiers
- Preferred name
- 2-Pyridin-3-yl-benzo[h]chromen-4-one
- IUPAC
- 2-pyridin-3-ylbenzo[h]chromen-4-one
Names & synonyms
MLS0007571161939-53-3CHEMBL1779384H-Naphtho[1,2-b]pyran-4-one, 2-(3-pyridinyl)-NSC-2838452-Pyridin-3-yl-benzo[h]chromen-4-oneNSC2838457,8-Benz-3'-azaflavoneKRH8M57WD7SCHEMBL31061509DTXSID00314472BDBM50159611
Show more names
PD180715SMR000449783DS-0004912-PYRIDIN-3-YLBENZO(H)CHROMEN-4-ONE2-(3-Pyridinyl)-4H-naphtho[1,2-b]pyran-4-one2-(Pyridin-3-yl)-4H-naphtho[1,2-b]pyran-4-one
Database identifiers
- CAS
1939-53-3- PubChem CID
- 323484
- DTXSID
DTXSID00314472- ChEMBL
CHEMBL177938- UNII
- KRH8M57WD7
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 444
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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