4(3H)-Quinazolinone, 3-(((((4-methoxyphenyl)amino)methyl)amino)methyl)-, dihydrochloride
Basic information
- CAS
75159-31-8- Standard SMILES
COc1ccc(NCNCn2cnc3ccccc3c2=O)cc1.Cl.Cl- InChIKey
AARWUODNYYQENI-UHFFFAOYSA-N- Molecular formula
- C17H20Cl2N4O2
- Average molar mass
- 383.3 g/mol
- Monoisotopic mass
- 382.0963313
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(((((4-methoxyphenyl)amino)methyl)amino)methyl)-, dihydrochloride
- IUPAC
- 3-[[(4-methoxyanilino)methylamino]methyl]quinazolin-4-one;dihydrochloride
Names & synonyms
4(3H)-Quinazolinone, 3-(((((4-methoxyphenyl)amino)methyl)amino)methyl)-, dihydrochloride75159-31-8DTXSID102261333-(((((4-Methoxyphenyl)amino)methyl)amino)methyl)-4(3H)-quinazolinone dihydrochlorideRefChem:283911DTXCID101486243-({[(4-Methoxyanilino)methyl]amino}methyl)quinazolin-4(3H)-one--hydrogen chloride (1/2)
Database identifiers
- CAS
75159-31-8- PubChem CID
- 63566
- DTXSID
DTXSID10226133
Properties
Computed structural properties
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 421
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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