Basic information
- CAS
75159-51-2- Standard SMILES
COc1ccccc1NCn1cnc2ccccc2c1=O.Cl.Cl- InChIKey
ITVFLURPOXEUKH-UHFFFAOYSA-N- Molecular formula
- C16H17Cl2N3O2
- Average molar mass
- 354.2 g/mol
- Monoisotopic mass
- 353.0697822
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(((2-methoxyphenyl)amino)methyl)-, dihydrochloride
- IUPAC
- 3-[(2-methoxyanilino)methyl]quinazolin-4-one;dihydrochloride
Names & synonyms
4(3H)-Quinazolinone, 3-(((2-methoxyphenyl)amino)methyl)-, dihydrochloride75159-51-2DTXSID902261513-(((2-Methoxyphenyl)amino)methyl)-4(3H)-quinazolinone dihydrochlorideRefChem:283922DTXCID901486423-[(2-Methoxyanilino)methyl]quinazolin-4(3H)-one--hydrogen chloride (1/2)
Database identifiers
- CAS
75159-51-2- PubChem CID
- 63576
- DTXSID
DTXSID90226151
Properties
Computed structural properties
- Topological polar surface area
- 53.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 399
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…