platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole]

C44H30GeN4OPt — CID 164702665

IUPACplatinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole]
SMILES[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)cccc1-n1ncc2c1-c1ccccc1[Ge]21C2=C(CCCC2)c2ccccc21
InChIInChI=1S/C44H30GeN4O.Pt/c1-5-18-37-32(14-1)33-15-2-6-19-38(33)45(37)39-20-7-3-17-36(39)44-40(45)28-47-49(44)29-12-11-13-30(26-29)50-31-23-24-35-34-16-4-8-21-41(34)48(42(35)27-31)43-22-9-10-25-46-43;/h1,3-5,7-14,16-18,20-25,28H,2,6,15,19H2;/q-2;+2
InChIKeyPIKJKNKNMMHYOL-UHFFFAOYSA-N
MW898.44 g/mol
LogP8.09
Rot. Bonds4

About platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole]

platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole] (PubChem CID 164702665) has the molecular formula C44H30GeN4OPt and a molecular weight of 898.44 g/mol. Its IUPAC name is platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole].

Molecular Properties

Compound Nameplatinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole]
PubChem CID164702665
Molecular FormulaC44H30GeN4OPt
Molecular Weight898.44 g/mol
Exact Mass899.13
IUPAC Nameplatinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole]
SMILES[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)cccc1-n1ncc2c1-c1ccccc1[Ge]21C2=C(CCCC2)c2ccccc21
InChIInChI=1S/C44H30GeN4O.Pt/c1-5-18-37-32(14-1)33-15-2-6-19-38(33)45(37)39-20-7-3-17-36(39)44-40(45)28-47-49(44)29-12-11-13-30(26-29)50-31-23-24-35-34-16-4-8-21-41(34)48(42(35)27-31)43-22-9-10-25-46-43;/h1,3-5,7-14,16-18,20-25,28H,2,6,15,19H2;/q-2;+2
InChIKeyPIKJKNKNMMHYOL-UHFFFAOYSA-N
XLogP8.09
TPSA44.87 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms51
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500898.44
LogP ≤ 58.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole] with MolForge

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Frequently Asked Questions

What is the IUPAC name of platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole]?
The IUPAC name of platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole] (CID 164702665) is platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole].
What is the SMILES notation for platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole]?
The canonical SMILES for platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole] is [Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)cccc1-n1ncc2c1-c1ccccc1[Ge]21C2=C(CCCC2)c2ccccc21.
What is the InChIKey of platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole]?
The InChIKey is PIKJKNKNMMHYOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H30GeN4O.Pt/c1-5-18-37-32(14-1)33-15-2-6-19-38(33)45(37)39-20-7-3-17-36(39)44-40(45)28-47-49(44)29-12-11-13-30(26-29)50-31-23-24-35-34-16-4-8-21-41(34)48(42(35)27-31)43-22-9-10-25-46-43;/h1,3-5,7-14,16-18,20-25,28H,2,6,15,19H2;/q-2;+2.
What are the key properties of platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole]?
platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole] has a molecular weight of 898.44 g/mol, XLogP of 8.09, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for platinum(2+);1'-[3-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]benzene-2-id-1-yl]spiro[6,7,8,9-tetrahydrobenzo[b][1]benzogermole-5,4'-[1]benzogermolo[2,3-d]pyrazole] is sourced from PubChem (CID 164702665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).