2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum

C22H18N4O2Pt — CID 135975770

IUPAC2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum
SMILESCn1c(-c2ccccc2O)nc2c3nc(-c4ccccc4O)n(C)c3ccc21.[Pt]
InChIInChI=1S/C22H18N4O2.Pt/c1-25-15-11-12-16-20(19(15)23-21(25)13-7-3-5-9-17(13)27)24-22(26(16)2)14-8-4-6-10-18(14)28;/h3-12,27-28H,1-2H3;
InChIKeySFMMRRORMYJBOX-UHFFFAOYSA-N
MW565.49 g/mol
LogP4.20
Rot. Bonds2

About 2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum

2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum (PubChem CID 135975770) has the molecular formula C22H18N4O2Pt and a molecular weight of 565.49 g/mol. Its IUPAC name is 2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum.

Molecular Properties

Compound Name2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum
PubChem CID135975770
Molecular FormulaC22H18N4O2Pt
Molecular Weight565.49 g/mol
Exact Mass565.11
IUPAC Name2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum
SMILESCn1c(-c2ccccc2O)nc2c3nc(-c4ccccc4O)n(C)c3ccc21.[Pt]
InChIInChI=1S/C22H18N4O2.Pt/c1-25-15-11-12-16-20(19(15)23-21(25)13-7-3-5-9-17(13)27)24-22(26(16)2)14-8-4-6-10-18(14)28;/h3-12,27-28H,1-2H3;
InChIKeySFMMRRORMYJBOX-UHFFFAOYSA-N
XLogP4.20
TPSA76.10 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500565.49
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[1-(2-hydroxybenzyl)-1H-benzimidazol-2-yl]phenol
CID 682797
2-[[[2-Methyl-1-(phenylmethyl)-5-benzimidazolyl]amino]methyl]phenol
CID 563543
2-[2-Methyl-6-[3-(1-methylbenzimidazol-2-yl)azetidin-1-yl]pyrimidin-4-yl]phenol
CID 136254060
6-[[(6-Methyl-9-indolo[3,2-b]quinoxalinyl)amino]methylidene]-1-cyclohexa-2,4-dienone
CID 1547739
4-[[4-[(1-Benzyl-2-methylbenzimidazol-5-yl)amino]-6-(4-fluoroanilino)-1,3,5-triazin-2-yl]amino]phenol
CID 127040931
2-[6-(quinazolin-4-ylamino)-1H-benzimidazol-2-yl]phenol
CID 137083622
2-[[2-(2-Hydroxyphenyl)-4-(4-methylpiperazin-1-yl)imidazo[4,5-c]pyridin-1-yl]methyl]phenol
CID 145955961
3-[2-(3-Hydroxyphenyl)-1,7-dipropylimidazo[4,5-f]benzimidazol-6-yl]phenol
CID 168273163
2-(5,6-Dihydro[1,3]benzimidazo[1,2-C]quinazolin-6-YL)phenol
CID 5193552
2-{(E)-[(1,2-dimethyl-1H-benzimidazol-5-yl)imino]methyl}phenol
CID 771793
CID 139166817
CID 139166817
2-[1-(2-Piperazin-1-ylethyl)-4-(trifluoromethyl)imidazo[4,5-c]quinolin-2-yl]phenol
CID 135404988

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum?
The IUPAC name of 2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum (CID 135975770) is 2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum.
What is the SMILES notation for 2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum?
The canonical SMILES for 2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum is Cn1c(-c2ccccc2O)nc2c3nc(-c4ccccc4O)n(C)c3ccc21.[Pt].
What is the InChIKey of 2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum?
The InChIKey is SFMMRRORMYJBOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O2.Pt/c1-25-15-11-12-16-20(19(15)23-21(25)13-7-3-5-9-17(13)27)24-22(26(16)2)14-8-4-6-10-18(14)28;/h3-12,27-28H,1-2H3;.
What are the key properties of 2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum?
2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum has a molecular weight of 565.49 g/mol, XLogP of 4.20, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyphenyl)-3,6-dimethylimidazo[4,5-e]benzimidazol-7-yl]phenol;platinum is sourced from PubChem (CID 135975770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).