7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one

C10H7BrClN3O — CID 135823920

IUPAC7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one
SMILESO=C1CN2Cc3c(ccc(Br)c3Cl)N=C2N1
InChIInChI=1S/C10H7BrClN3O/c11-6-1-2-7-5(9(6)12)3-15-4-8(16)14-10(15)13-7/h1-2H,3-4H2,(H,13,14,16)
InChIKeyWOMVONYQNTYHEW-UHFFFAOYSA-N
MW300.54 g/mol
LogP2.04
Rot. Bonds

About 7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one

7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one (PubChem CID 135823920) has the molecular formula C10H7BrClN3O and a molecular weight of 300.54 g/mol. Its IUPAC name is 7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one.

Molecular Properties

Compound Name7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one
PubChem CID135823920
Molecular FormulaC10H7BrClN3O
Molecular Weight300.54 g/mol
Exact Mass298.95
IUPAC Name7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one
SMILESO=C1CN2Cc3c(ccc(Br)c3Cl)N=C2N1
InChIInChI=1S/C10H7BrClN3O/c11-6-1-2-7-5(9(6)12)3-15-4-8(16)14-10(15)13-7/h1-2H,3-4H2,(H,13,14,16)
InChIKeyWOMVONYQNTYHEW-UHFFFAOYSA-N
XLogP2.04
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.54
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one?
The IUPAC name of 7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one (CID 135823920) is 7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one.
What is the SMILES notation for 7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one?
The canonical SMILES for 7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one is O=C1CN2Cc3c(ccc(Br)c3Cl)N=C2N1.
What is the InChIKey of 7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one?
The InChIKey is WOMVONYQNTYHEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrClN3O/c11-6-1-2-7-5(9(6)12)3-15-4-8(16)14-10(15)13-7/h1-2H,3-4H2,(H,13,14,16).
What are the key properties of 7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one?
7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one has a molecular weight of 300.54 g/mol, XLogP of 2.04, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-6-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one is sourced from PubChem (CID 135823920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).