Basic information
- CAS
79490-77-0- Standard SMILES
CN1C(=O)CN=C(c2ccccc2F)c2cc(N=O)ccc21- InChIKey
HVPMFRAWYYPBKP-UHFFFAOYSA-N- Molecular formula
- C16H12FN3O2
- Average molar mass
- 297.28 g/mol
- Monoisotopic mass
- 297.0913548
Names & identifiers
- Preferred name
- 2H-1,4-Benzodiazepin-2-one, 5-(2-fluorophenyl)-1,3-dihydro-1-methyl-7-nitroso-
- IUPAC
- 5-(2-fluorophenyl)-1-methyl-7-nitroso-3H-1,4-benzodiazepin-2-one
- English name
- 5-(2-Fluorophenyl)-1,3-dihydro-1-methyl-7-nitroso-2H-1,4-benzodiazepin -2-one
- Molecular weight
- 0
Names & synonyms
79490-77-02H-1,4-Benzodiazepin-2-one, 5-(2-fluorophenyl)-1,3-dihydro-1-methyl-7-nitroso-5-(2-Fluorophenyl)-1,3-dihydro-1-methyl-7-nitroso-2H-1,4-benzodiazepin-2-oneDTXSID202297115-(2-Fluorophenyl)-1-methyl-7-nitroso-1,3-dihydro-2H-1,4-benzodiazepin-2-one5-(2-Fluorophenyl)-1,3-dihydro-1-methyl-7-nitroso-2H-1,4-benzodiazepin -2-one
Database identifiers
- CAS
79490-77-0- PubChem CID
- 149779
- DTXSID
DTXSID20229711
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 62.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 482
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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