2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one

C14H8ClN3O — CID 135443886

IUPAC2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one
SMILESO=c1[nH]c2ccc(Cl)cc2c2nc3ccccc3n12
InChIInChI=1S/C14H8ClN3O/c15-8-5-6-10-9(7-8)13-16-11-3-1-2-4-12(11)18(13)14(19)17-10/h1-7H,(H,17,19)
InChIKeyOOJSSUSMVVJCJS-UHFFFAOYSA-N
MW269.69 g/mol
LogP2.98
Rot. Bonds

About 2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one

2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one (PubChem CID 135443886) has the molecular formula C14H8ClN3O and a molecular weight of 269.69 g/mol. Its IUPAC name is 2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one.

Molecular Properties

Compound Name2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one
PubChem CID135443886
Molecular FormulaC14H8ClN3O
Molecular Weight269.69 g/mol
Exact Mass269.04
IUPAC Name2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one
SMILESO=c1[nH]c2ccc(Cl)cc2c2nc3ccccc3n12
InChIInChI=1S/C14H8ClN3O/c15-8-5-6-10-9(7-8)13-16-11-3-1-2-4-12(11)18(13)14(19)17-10/h1-7H,(H,17,19)
InChIKeyOOJSSUSMVVJCJS-UHFFFAOYSA-N
XLogP2.98
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.69
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1H-1,3-Benzodiazol-2-YL)-4-chloroaniline
CID 318088
6-(2-Chlorophenyl)benzo[4,5]imidazo[1,2-c]-quinazoline
CID 630151
7-Chloro-1,3-dihydro-imidazo[4,5-b]quinolin-2-one
CID 13936972
5-Chloro-1-(phenylmethyl)-2-piperazin-1-ylbenzimidazole
CID 10806082
N-{2-[1-(4-chlorobenzyl)-1H-benzimidazol-2-yl]ethyl}acetamide
CID 1505390
5H-spiro[benzimidazo[1,2-c]quinazoline-6,1'-cyclohexane]
CID 618861
9-Chloro-6-ethyl-6H-indolo(2,3-b)quinoxaline
CID 1523680
spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane]
CID 2999723
9-Chloro-6-methylindolo[3,2-b]quinoxaline
CID 3155707
6-Methyl-6-phenyl-5,6-dihydrobenzimidazo[1,2-c]quinazoline
CID 3973344
4-(3-Chlorophenyl)-1,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
CID 4860084
1,3-dihydro-7-chloro-6-methyl-2Himidazo[4,5-b]quinolin-2-one
CID 15065145

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one?
The IUPAC name of 2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one (CID 135443886) is 2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one.
What is the SMILES notation for 2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one?
The canonical SMILES for 2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one is O=c1[nH]c2ccc(Cl)cc2c2nc3ccccc3n12.
What is the InChIKey of 2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one?
The InChIKey is OOJSSUSMVVJCJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8ClN3O/c15-8-5-6-10-9(7-8)13-16-11-3-1-2-4-12(11)18(13)14(19)17-10/h1-7H,(H,17,19).
What are the key properties of 2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one?
2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one has a molecular weight of 269.69 g/mol, XLogP of 2.98, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5H-benzimidazolo[1,2-c]quinazolin-6-one is sourced from PubChem (CID 135443886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).