4(3H)-Quinazolinone, 3-(aminomethyl)-6,8-dichloro-, dihydrochloride

HCID 63284

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 75159-35-2
Standard SMILES: Cl.Cl.NCn1cnc2c(Cl)cc(Cl)cc2c1=O
InChIKey: LHNJAJKRUGMGAT-UHFFFAOYSA-N
Molecular formula: C9H9Cl4N3O
Average molar mass: 317 g/mol
Monoisotopic mass: 314.949973

Names & identifiers

Preferred name: 4(3H)-Quinazolinone, 3-(aminomethyl)-6,8-dichloro-, dihydrochloride
IUPAC: 3-(aminomethyl)-6,8-dichloroquinazolin-4-one;dihydrochloride

Names & synonyms

75159-35-24(3H)-Quinazolinone, 3-(aminomethyl)-6,8-dichloro-, dihydrochloride3-(Aminomethyl)-6,8-dichloro-4(3H)-quinazolinone dihydrochlorideDTXSID50226137RefChem:284130DTXCID501486283-(Aminomethyl)-6,8-dichloroquinazolin-4(3H)-one--hydrogen chloride (1/2)

Database identifiers

CAS: 75159-35-2
PubChem CID: 63284
DTXSID: DTXSID50226137

Properties

Computed structural properties

Topological polar surface area: 58.7 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 17
Formal charge: 0
Complexity: 297

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…