dichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate

C18H13Cl2N3O2Pt — CID 58251826

IUPACdichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate
SMILESCl[Pt]Cl.O=COCn1c(-c2cccc3cccnc23)nc2ccccc21
InChIInChI=1S/C18H13N3O2.2ClH.Pt/c22-12-23-11-21-16-9-2-1-8-15(16)20-18(21)14-7-3-5-13-6-4-10-19-17(13)14;;;/h1-10,12H,11H2;2*1H;/q;;;+2/p-2
InChIKeyFJXDCFAJDIQQNZ-UHFFFAOYSA-L
MW569.31 g/mol
LogP4.76
Rot. Bonds4

About dichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate

dichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate (PubChem CID 58251826) has the molecular formula C18H13Cl2N3O2Pt and a molecular weight of 569.31 g/mol. Its IUPAC name is dichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate.

Molecular Properties

Compound Namedichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate
PubChem CID58251826
Molecular FormulaC18H13Cl2N3O2Pt
Molecular Weight569.31 g/mol
Exact Mass568.00
IUPAC Namedichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate
SMILESCl[Pt]Cl.O=COCn1c(-c2cccc3cccnc23)nc2ccccc21
InChIInChI=1S/C18H13N3O2.2ClH.Pt/c22-12-23-11-21-16-9-2-1-8-15(16)20-18(21)14-7-3-5-13-6-4-10-19-17(13)14;;;/h1-10,12H,11H2;2*1H;/q;;;+2/p-2
InChIKeyFJXDCFAJDIQQNZ-UHFFFAOYSA-L
XLogP4.76
TPSA57.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500569.31
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

dichloroplatinum;8-[1-(3-methylbutyl)benzimidazol-2-yl]quinoline
CID 58251814
2-(2-quinolin-8-ylbenzimidazol-1-yl)acetic acid
CID 42634637
carbanide;8-(1-propylbenzimidazol-2-yl)quinoline;trichloroplatinum
CID 58251767
difluoro-(2-quinolin-8-ylbenzimidazol-1-yl)borane
CID 132535146
8-(1-phenylbenzimidazol-2-yl)quinoline
CID 23527786
carbanide;1-(4-fluorophenyl)-4-(2-quinolin-8-ylbenzimidazol-1-yl)butan-1-one;trichloroplatinum
CID 58251828
5-(dimethylamino)-N-[2-(2-quinolin-8-ylbenzimidazol-1-yl)ethyl]naphthalene-1-sulfonamide
CID 42634812
2-(2-pyridin-2-ylbenzimidazol-1-yl)acetaldehyde
CID 89031622
2-(2-chloro-3-pyridinyl)-1-[(3,4-dichlorophenyl)methyl]benzimidazole
CID 4303515
3-[1-(isocyanomethyl)benzimidazol-2-yl]pyridin-2-amine
CID 59011555
2-(2-chlorophenyl)-1-propylbenzimidazole
CID 4637054
cobalt(3+);1-(methoxymethyl)-2-[6-[1-(methoxymethyl)benzimidazol-2-yl]-2-pyridinyl]benzimidazole;trichloride
CID 70015423

Frequently Asked Questions

What is the IUPAC name of dichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate?
The IUPAC name of dichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate (CID 58251826) is dichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate.
What is the SMILES notation for dichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate?
The canonical SMILES for dichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate is Cl[Pt]Cl.O=COCn1c(-c2cccc3cccnc23)nc2ccccc21.
What is the InChIKey of dichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate?
The InChIKey is FJXDCFAJDIQQNZ-UHFFFAOYSA-L. The full InChI is InChI=1S/C18H13N3O2.2ClH.Pt/c22-12-23-11-21-16-9-2-1-8-15(16)20-18(21)14-7-3-5-13-6-4-10-19-17(13)14;;;/h1-10,12H,11H2;2*1H;/q;;;+2/p-2.
What are the key properties of dichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate?
dichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate has a molecular weight of 569.31 g/mol, XLogP of 4.76, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for dichloroplatinum;(2-quinolin-8-ylbenzimidazol-1-yl)methyl formate is sourced from PubChem (CID 58251826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).