(6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline

C21H14ClN5 — CID 135726001

IUPAC(6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
SMILESClc1nc2ccccn2c1[C@@H]1Nc2ccccc2-c2nc3ccccc3n21
InChIInChI=1S/C21H14ClN5/c22-19-18(26-12-6-5-11-17(26)25-19)21-23-14-8-2-1-7-13(14)20-24-15-9-3-4-10-16(15)27(20)21/h1-12,21,23H/t21-/m1/s1
InChIKeyFBVAXOCJMHAYOW-OAQYLSRUSA-N
MW371.83 g/mol
LogP4.98
Rot. Bonds1

About (6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline

(6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline (PubChem CID 135726001) has the molecular formula C21H14ClN5 and a molecular weight of 371.83 g/mol. Its IUPAC name is (6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline.

Molecular Properties

Compound Name(6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
PubChem CID135726001
Molecular FormulaC21H14ClN5
Molecular Weight371.83 g/mol
Exact Mass371.09
IUPAC Name(6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
SMILESClc1nc2ccccn2c1[C@@H]1Nc2ccccc2-c2nc3ccccc3n21
InChIInChI=1S/C21H14ClN5/c22-19-18(26-12-6-5-11-17(26)25-19)21-23-14-8-2-1-7-13(14)20-24-15-9-3-4-10-16(15)27(20)21/h1-12,21,23H/t21-/m1/s1
InChIKeyFBVAXOCJMHAYOW-OAQYLSRUSA-N
XLogP4.98
TPSA47.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.83
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline with MolForge

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Related Compounds

(6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 731211
2-(5,6-dihydrobenzimidazolo[1,2-c]quinazolin-6-yl)phenol
CID 5193552
2-[(6R)-5,6-dihydrobenzimidazolo[1,2-c]quinazolin-6-yl]aniline
CID 139076751
(6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 733578
(6S)-6-(2-chloro-6-fluorophenyl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 135562411
(6S)-6-(4-methylsulfanylphenyl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 135874224
6-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 3904936
ethane;6-pyren-1-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 143486448
6-(4,6-diphenylpyrimidin-2-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 136931573
(6S)-6-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 135562407
6-(6-chloro-3-methyl-1-phenylpyrazolo[3,4-b]pyridin-5-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 3942276
3-(5,6-dihydrobenzimidazolo[1,2-c]quinazolin-6-yl)phenol
CID 3664354

Frequently Asked Questions

What is the IUPAC name of (6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline?
The IUPAC name of (6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline (CID 135726001) is (6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline.
What is the SMILES notation for (6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline?
The canonical SMILES for (6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline is Clc1nc2ccccn2c1[C@@H]1Nc2ccccc2-c2nc3ccccc3n21.
What is the InChIKey of (6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline?
The InChIKey is FBVAXOCJMHAYOW-OAQYLSRUSA-N. The full InChI is InChI=1S/C21H14ClN5/c22-19-18(26-12-6-5-11-17(26)25-19)21-23-14-8-2-1-7-13(14)20-24-15-9-3-4-10-16(15)27(20)21/h1-12,21,23H/t21-/m1/s1.
What are the key properties of (6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline?
(6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline has a molecular weight of 371.83 g/mol, XLogP of 4.98, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-(2-chloroimidazo[1,2-a]pyridin-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline is sourced from PubChem (CID 135726001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).