4(3H)-Quinazolinone, 6-amino-2-(hydroxymethyl)-3-(2-methylphenyl)-, dihydrochloride
Basic information
- CAS
73832-49-2- Standard SMILES
Cc1ccccc1-n1c(CO)nc2ccc(N)cc2c1=O.Cl.Cl- InChIKey
RGAGUCHDNOBIMP-UHFFFAOYSA-N- Molecular formula
- C16H17Cl2N3O2
- Average molar mass
- 354.2 g/mol
- Monoisotopic mass
- 353.0697822
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 6-amino-2-(hydroxymethyl)-3-(2-methylphenyl)-, dihydrochloride
- IUPAC
- 6-amino-2-(hydroxymethyl)-3-(2-methylphenyl)quinazolin-4-one;dihydrochloride
Names & synonyms
4(3H)-Quinazolinone, 6-amino-2-(hydroxymethyl)-3-(2-methylphenyl)-, dihydrochloride73832-49-2DTXSID902243546-Amino-2-(hydroxymethyl)-3-(2-methylphenyl)-4(3H)-quinazolinone dihydrochlorideRefChem:284240DTXCID901468456-Amino-2-(hydroxymethyl)-3-(2-methylphenyl)quinazolin-4(3H)-one--hydrogen chloride (1/2)
Database identifiers
- CAS
73832-49-2- PubChem CID
- 63531
- DTXSID
DTXSID90224354
Properties
Computed structural properties
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 437
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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