Basic information
- CAS
75159-41-0- Standard SMILES
Cl.Cl.O=c1c2ccccc2ncn1CN(CCO)CCO- InChIKey
RGHAKGVMROUCEU-UHFFFAOYSA-N- Molecular formula
- C13H19Cl2N3O3
- Average molar mass
- 336.21 g/mol
- Monoisotopic mass
- 335.0803469
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-((bis(2-hydroxyethyl)amino)methyl)-, dihydrochloride
- IUPAC
- 3-[[bis(2-hydroxyethyl)amino]methyl]quinazolin-4-one;dihydrochloride
Names & synonyms
75159-41-04(3H)-Quinazolinone, 3-((bis(2-hydroxyethyl)amino)methyl)-, dihydrochloride3-((Bis(2-hydroxyethyl)amino)methyl)-4(3H)-quinazolinone dihydrochlorideRefChem:283937DTXSID609966323-{[Bis(2-hydroxyethyl)amino]methyl}quinazolin-4(3H)-one--hydrogen chloride (1/2)
Database identifiers
- CAS
75159-41-0- PubChem CID
- 63572
- DTXSID
DTXSID60996632
Properties
Computed structural properties
- Topological polar surface area
- 76.4 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 329
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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