6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one

C12H11Cl2N3O — CID 135564921

IUPAC6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one
SMILESCC1(C)C(=O)NC2=Nc3ccc(Cl)c(Cl)c3CN21
InChIInChI=1S/C12H11Cl2N3O/c1-12(2)10(18)16-11-15-8-4-3-7(13)9(14)6(8)5-17(11)12/h3-4H,5H2,1-2H3,(H,15,16,18)
InChIKeyIGMDPBNGNRHCRW-UHFFFAOYSA-N
MW284.15 g/mol
LogP2.70
Rot. Bonds

About 6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one

6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one (PubChem CID 135564921) has the molecular formula C12H11Cl2N3O and a molecular weight of 284.15 g/mol. Its IUPAC name is 6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one.

Molecular Properties

Compound Name6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one
PubChem CID135564921
Molecular FormulaC12H11Cl2N3O
Molecular Weight284.15 g/mol
Exact Mass283.03
IUPAC Name6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one
SMILESCC1(C)C(=O)NC2=Nc3ccc(Cl)c(Cl)c3CN21
InChIInChI=1S/C12H11Cl2N3O/c1-12(2)10(18)16-11-15-8-4-3-7(13)9(14)6(8)5-17(11)12/h3-4H,5H2,1-2H3,(H,15,16,18)
InChIKeyIGMDPBNGNRHCRW-UHFFFAOYSA-N
XLogP2.70
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.15
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Anagrelide
CID 135409400
Anagrelide Hydrochloride
CID 135413494
Quazinone
CID 135418296
Anagrelide Hydrochloride Hydrate
CID 135565321
6,7-Dichloro-3-hydroxy-1,5 dihydro-imidazo(2,1-b)quinazolin-2-one
CID 135424310
7-chloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one
CID 136058108
Dechloro Anagrelide
CID 136125465
6-chloro-7-fluoro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one
CID 171345689
Dazonone
CID 135511466
Anagrelide impurity 1
CID 9818697
Anagrelide trichloro derivative
CID 135565383
2-[(5,6-Dichloro-1,4-dihydroquinazolin-2-yl)amino]-2-oxoacetyl fluoride
CID 143181681

Frequently Asked Questions

What is the IUPAC name of 6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one?
The IUPAC name of 6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one (CID 135564921) is 6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one.
What is the SMILES notation for 6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one?
The canonical SMILES for 6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one is CC1(C)C(=O)NC2=Nc3ccc(Cl)c(Cl)c3CN21.
What is the InChIKey of 6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one?
The InChIKey is IGMDPBNGNRHCRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Cl2N3O/c1-12(2)10(18)16-11-15-8-4-3-7(13)9(14)6(8)5-17(11)12/h3-4H,5H2,1-2H3,(H,15,16,18).
What are the key properties of 6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one?
6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one has a molecular weight of 284.15 g/mol, XLogP of 2.70, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dichloro-3,3-dimethyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-one is sourced from PubChem (CID 135564921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).