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

C19H14N4 — CID 733578

IUPAC(6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
SMILESc1ccc([C@@H]2Nc3ccccc3-c3nc4ccccc4n32)nc1
InChIInChI=1S/C19H14N4/c1-2-8-14-13(7-1)18-22-15-9-3-4-11-17(15)23(18)19(21-14)16-10-5-6-12-20-16/h1-12,19,21H/t19-/m1/s1
InChIKeyZMZZAQWHHFSQPH-LJQANCHMSA-N
MW298.35 g/mol
LogP4.07
Rot. Bonds1

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

(6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline (PubChem CID 733578) has the molecular formula C19H14N4 and a molecular weight of 298.35 g/mol. Its IUPAC name is (6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline.

Molecular Properties

Compound Name(6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
PubChem CID733578
Molecular FormulaC19H14N4
Molecular Weight298.35 g/mol
Exact Mass298.12
IUPAC Name(6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
SMILESc1ccc([C@@H]2Nc3ccccc3-c3nc4ccccc4n32)nc1
InChIInChI=1S/C19H14N4/c1-2-8-14-13(7-1)18-22-15-9-3-4-11-17(15)23(18)19(21-14)16-10-5-6-12-20-16/h1-12,19,21H/t19-/m1/s1
InChIKeyZMZZAQWHHFSQPH-LJQANCHMSA-N
XLogP4.07
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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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
6-(4,6-diphenylpyrimidin-2-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 136931573
2-[(6R)-5,6-dihydrobenzimidazolo[1,2-c]quinazolin-6-yl]aniline
CID 139076751
3-(5,6-dihydrobenzimidazolo[1,2-c]quinazolin-6-yl)phenol
CID 3664354
(6S)-6-(4-methylsulfanylphenyl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 135874224
(6S)-6-(2,5-dimethyl-1-phenylpyrrol-3-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 135904837
(6S)-6-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 135562407
(6R)-6-(4-nitrophenyl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 752491
(6S)-6-(2-chloro-6-fluorophenyl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 135562411
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

Frequently Asked Questions

What is the IUPAC name of (6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline?
The IUPAC name of (6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline (CID 733578) is (6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline.
What is the SMILES notation for (6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline?
The canonical SMILES for (6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline is c1ccc([C@@H]2Nc3ccccc3-c3nc4ccccc4n32)nc1.
What is the InChIKey of (6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline?
The InChIKey is ZMZZAQWHHFSQPH-LJQANCHMSA-N. The full InChI is InChI=1S/C19H14N4/c1-2-8-14-13(7-1)18-22-15-9-3-4-11-17(15)23(18)19(21-14)16-10-5-6-12-20-16/h1-12,19,21H/t19-/m1/s1.
What are the key properties of (6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline?
(6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline has a molecular weight of 298.35 g/mol, XLogP of 4.07, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline is sourced from PubChem (CID 733578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).