5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+)

C39H41N5O2Pt — CID 155633427

IUPAC5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+)
SMILESCc1nn(-c2[c-]c(Oc3[c-]c(Oc4cc(C(C)(C)C)ccn4)n4c(C(C)C)c(C(C)C)nc4c3)ccc2)c(C)c1-c1ccccc1.[Pt+2]
InChIInChI=1S/C39H41N5O2.Pt/c1-24(2)37-38(25(3)4)43-33(41-37)22-32(23-35(43)46-34-20-29(18-19-40-34)39(7,8)9)45-31-17-13-16-30(21-31)44-27(6)36(26(5)42-44)28-14-11-10-12-15-28;/h10-20,22,24-25H,1-9H3;/q-2;+2
InChIKeySWKVWDYLGOOLGM-UHFFFAOYSA-N
MW806.87 g/mol
LogP9.93
Rot. Bonds8

About 5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+)

5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+) (PubChem CID 155633427) has the molecular formula C39H41N5O2Pt and a molecular weight of 806.87 g/mol. Its IUPAC name is 5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+).

Molecular Properties

Compound Name5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+)
PubChem CID155633427
Molecular FormulaC39H41N5O2Pt
Molecular Weight806.87 g/mol
Exact Mass806.29
IUPAC Name5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+)
SMILESCc1nn(-c2[c-]c(Oc3[c-]c(Oc4cc(C(C)(C)C)ccn4)n4c(C(C)C)c(C(C)C)nc4c3)ccc2)c(C)c1-c1ccccc1.[Pt+2]
InChIInChI=1S/C39H41N5O2.Pt/c1-24(2)37-38(25(3)4)43-33(41-37)22-32(23-35(43)46-34-20-29(18-19-40-34)39(7,8)9)45-31-17-13-16-30(21-31)44-27(6)36(26(5)42-44)28-14-11-10-12-15-28;/h10-20,22,24-25H,1-9H3;/q-2;+2
InChIKeySWKVWDYLGOOLGM-UHFFFAOYSA-N
XLogP9.93
TPSA66.47 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500806.87
LogP ≤ 59.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-Methoxyphenyl)-1-methyl-6-phenyl-3-pyridin-4-ylimidazo[2,1-e]pyrazole
CID 102313335
(imidazo[1,2-a]pyridin-3-ylmethyl)methyl{[1-methyl-3-(4-phenoxyphenyl)-1H-pyrazol-4-yl]methyl}amine
CID 16190922
2-(4-Methoxyphenyl)-1-methyl-7-[(4-methylpiperazin-1-yl)methyl]-6-phenylimidazo[2,1-e]pyrazole
CID 118710903
4-[[2-(4-Methoxyphenyl)-1-methyl-6-phenyl-3-pyridin-4-ylimidazo[2,1-e]pyrazol-7-yl]methyl]morpholine
CID 118710928
6-(1-Benzylpyrazol-4-yl)-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazine
CID 155562430
3-Imidazo[1,2-a]pyridin-3-yl-6-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine
CID 60182396
2,3-Bis(4-methoxyphenyl)-1-methyl-6-phenyl-7-pyridin-4-ylimidazo[2,1-e]pyrazole
CID 118710892
1-(1-ethyl-1H-imidazol-2-yl)-N-methyl-N-{[1-methyl-3-(4-phenoxyphenyl)-1H-pyrazol-4-yl]methyl}methanamine
CID 42511621
6-(1-Methylpyrazol-4-yl)-3-(4-phenoxyphenyl) imidazo[1,2-a]pyrazine
CID 126672977
6-[3-(4-fluorophenyl)-1-trityl-1H-4-pyrazolyl]-3-(6-methoxy-2-pyridyl)imidazo[1,2-a]pyridine
CID 22031149
6-[3-(4-Fluorophenyl)-1-tritylpyrazol-4-yl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyridine
CID 22031999
6-[3-(4-Fluorophenyl)-1-tritylpyrazol-4-yl]-3-(4-methoxyphenyl)-7-methylimidazo[1,2-a]pyridine
CID 23537393

Frequently Asked Questions

What is the IUPAC name of 5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+)?
The IUPAC name of 5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+) (CID 155633427) is 5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+).
What is the SMILES notation for 5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+)?
The canonical SMILES for 5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+) is Cc1nn(-c2[c-]c(Oc3[c-]c(Oc4cc(C(C)(C)C)ccn4)n4c(C(C)C)c(C(C)C)nc4c3)ccc2)c(C)c1-c1ccccc1.[Pt+2].
What is the InChIKey of 5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+)?
The InChIKey is SWKVWDYLGOOLGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H41N5O2.Pt/c1-24(2)37-38(25(3)4)43-33(41-37)22-32(23-35(43)46-34-20-29(18-19-40-34)39(7,8)9)45-31-17-13-16-30(21-31)44-27(6)36(26(5)42-44)28-14-11-10-12-15-28;/h10-20,22,24-25H,1-9H3;/q-2;+2.
What are the key properties of 5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+)?
5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+) has a molecular weight of 806.87 g/mol, XLogP of 9.93, 8 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-tert-butyl-2-pyridinyl)oxy]-7-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-2,3-di(propan-2-yl)-6H-imidazo[1,2-a]pyridin-6-ide;platinum(2+) is sourced from PubChem (CID 155633427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).