CID 71440216

C5H6N5PtSe+2 — CID 71440216

IUPAC—
SMILES[H]/[Se]=c1\[nH]c(N)nc2nc[nH]c12.[Pt+2]
InChIInChI=1S/C5H6N5Se.Pt/c6-5-9-3-2(4(11)10-5)7-1-8-3;/h1,11H,(H,7,8)(H3,6,9,10);/q;+2
InChIKeyCNPDHTPKGMGUIR-UHFFFAOYSA-N
MW410.18 g/mol
LogP-0.70
Rot. Bonds

About CID 71440216

CID 71440216 (PubChem CID 71440216) has the molecular formula C5H6N5PtSe+2 and a molecular weight of 410.18 g/mol.

Molecular Properties

Compound NameCID 71440216
PubChem CID71440216
Molecular FormulaC5H6N5PtSe+2
Molecular Weight410.18 g/mol
Exact Mass410.94
IUPAC Name—
SMILES[H]/[Se]=c1\[nH]c(N)nc2nc[nH]c12.[Pt+2]
InChIInChI=1S/C5H6N5Se.Pt/c6-5-9-3-2(4(11)10-5)7-1-8-3;/h1,11H,(H,7,8)(H3,6,9,10);/q;+2
InChIKeyCNPDHTPKGMGUIR-UHFFFAOYSA-N
XLogP-0.70
TPSA83.38 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.18
LogP ≤ 5-0.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

CID 71440217
CID 71440217
2-amino-1,7-dihydropurin-6-one;dihydrochloride
CID 140978979
magnesium;2-amino-1,7-dihydropurin-6-one;dichloride
CID 174866452
bis(2-amino-1,7-dihydropurin-6-one);trihydrate;dihydroiodide
CID 135724792
2-amino-1,7-dihydropurin-6-one;copper;dihydrate
CID 139263394
2-amino-1,7-dihydropurin-6-one;methoxymethane
CID 170791174
2-amino-1,7-dihydropurin-6-one;2-sulfanylacetic acid
CID 157072098
2-amino-1,7-dihydropurin-6-one;anthracene-9,10-dione
CID 136626730
2-amino-1,7-dihydropurin-6-one;phosphoric acid;7H-purin-6-amine
CID 172703090
2-chloro-7H-purin-6-amine;2-chloro-7H-purin-8-amine
CID 159573001
6-amino-1,7-dihydropurin-2-one;hydrochloride
CID 67634855
2-amino-1,7-dihydropurin-6-one;5-methyl-1H-pyrimidine-2,4-dione;phosphoric acid
CID 159240828

Frequently Asked Questions

What is the IUPAC name of CID 71440216?
The IUPAC name of CID 71440216 (CID 71440216) is not available.
What is the SMILES notation for CID 71440216?
The canonical SMILES for CID 71440216 is [H]/[Se]=c1\[nH]c(N)nc2nc[nH]c12.[Pt+2].
What is the InChIKey of CID 71440216?
The InChIKey is CNPDHTPKGMGUIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N5Se.Pt/c6-5-9-3-2(4(11)10-5)7-1-8-3;/h1,11H,(H,7,8)(H3,6,9,10);/q;+2.
What are the key properties of CID 71440216?
CID 71440216 has a molecular weight of 410.18 g/mol, XLogP of -0.70, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 71440216 is sourced from PubChem (CID 71440216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).