4(3H)-Quinazolinone, 6,8-dibromo-2-ethyl-3-(2-((1-methylethyl)amino)ethyl)-
Basic information
- CAS
77301-03-2- Standard SMILES
CCc1nc2c(Br)cc(Br)cc2c(=O)n1CCNC(C)C- InChIKey
BNHDBTHIFGSWJL-UHFFFAOYSA-N- Molecular formula
- C15H19Br2N3O
- Average molar mass
- 417.14 g/mol
- Monoisotopic mass
- 414.98949
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 6,8-dibromo-2-ethyl-3-(2-((1-methylethyl)amino)ethyl)-
- IUPAC
- 6,8-dibromo-2-ethyl-3-[2-(propan-2-ylamino)ethyl]quinazolin-4-one
Names & synonyms
77301-03-24(3H)-Quinazolinone, 6,8-dibromo-2-ethyl-3-(2-((1-methylethyl)amino)ethyl)-6,8-Dibromo-2-ethyl-3-(2-((1-methylethyl)amino)ethyl)-4(3H)-quinazolinoneDTXSID10228036RefChem:284197DTXCID301505276,8-Dibromo-2-ethyl-3-{2-[(propan-2-yl)amino]ethyl}quinazolin-4(3H)-one
Database identifiers
- CAS
77301-03-2- PubChem CID
- 63596
- DTXSID
DTXSID10228036
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 44.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 414
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Compound notes
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