(6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline

C20H15N3 — CID 731211

IUPAC(6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
SMILESc1ccc([C@H]2Nc3ccccc3-c3nc4ccccc4n32)cc1
InChIInChI=1S/C20H15N3/c1-2-8-14(9-3-1)19-21-16-11-5-4-10-15(16)20-22-17-12-6-7-13-18(17)23(19)20/h1-13,19,21H/t19-/m0/s1
InChIKeyRWRCHUYKIHRERJ-IBGZPJMESA-N
MW297.36 g/mol
LogP4.68
Rot. Bonds1

About (6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline

(6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline (PubChem CID 731211) has the molecular formula C20H15N3 and a molecular weight of 297.36 g/mol. Its IUPAC name is (6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline.

Molecular Properties

Compound Name(6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
PubChem CID731211
Molecular FormulaC20H15N3
Molecular Weight297.36 g/mol
Exact Mass297.13
IUPAC Name(6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
SMILESc1ccc([C@H]2Nc3ccccc3-c3nc4ccccc4n32)cc1
InChIInChI=1S/C20H15N3/c1-2-8-14(9-3-1)19-21-16-11-5-4-10-15(16)20-22-17-12-6-7-13-18(17)23(19)20/h1-13,19,21H/t19-/m0/s1
InChIKeyRWRCHUYKIHRERJ-IBGZPJMESA-N
XLogP4.68
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(6S)-6-(4-methylsulfanylphenyl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 135874224
3-(5,6-dihydrobenzimidazolo[1,2-c]quinazolin-6-yl)phenol
CID 3664354
(6R)-6-(4-nitrophenyl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 752491
2-(5,6-dihydrobenzimidazolo[1,2-c]quinazolin-6-yl)phenol
CID 5193552
(6R)-6-pyridin-2-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 733578
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
5-[(6S)-5,6-dihydrobenzimidazolo[1,2-c]quinazolin-6-yl]-2-methoxyphenol
CID 135904843
(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
(6S)-6-(2-chloro-6-fluorophenyl)-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 135562411
ethane;6-pyren-1-yl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline
CID 143486448

Frequently Asked Questions

What is the IUPAC name of (6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline?
The IUPAC name of (6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline (CID 731211) is (6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline.
What is the SMILES notation for (6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline?
The canonical SMILES for (6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline is c1ccc([C@H]2Nc3ccccc3-c3nc4ccccc4n32)cc1.
What is the InChIKey of (6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline?
The InChIKey is RWRCHUYKIHRERJ-IBGZPJMESA-N. The full InChI is InChI=1S/C20H15N3/c1-2-8-14(9-3-1)19-21-16-11-5-4-10-15(16)20-22-17-12-6-7-13-18(17)23(19)20/h1-13,19,21H/t19-/m0/s1.
What are the key properties of (6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline?
(6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline has a molecular weight of 297.36 g/mol, XLogP of 4.68, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-6-phenyl-5,6-dihydrobenzimidazolo[1,2-c]quinazoline is sourced from PubChem (CID 731211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).