2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+)

C108H82ClN13O4Pt2 — CID 157417856

IUPAC2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+)
SMILESCc1cc(C)n(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(-c4ccccc4)ccn3)ccc2)n1.Cc1cc(C)n(-c2cccc(Oc3ccc4c(c3)[nH]c3ccccc34)c2)n1.Cc1cc(C)n(-c2cccc(Oc3ccc4c5ccccc5n(-c5cc(-c6ccccc6)ccn5)c4c3)c2)n1.Clc1cc(-c2ccccc2)ccn1.O=[Pt]=Nc1ccccc1.[Pt+2]
InChIInChI=1S/C34H26N4O.C34H24N4O.C23H19N3O.C11H8ClN.C6H5N.O.2Pt/c2*1-23-19-24(2)38(36-23)27-11-8-12-28(21-27)39-29-15-16-31-30-13-6-7-14-32(30)37(33(31)22-29)34-20-26(17-18-35-34)25-9-4-3-5-10-25;1-15-12-16(2)26(25-15)17-6-5-7-18(13-17)27-19-10-11-21-20-8-3-4-9-22(20)24-23(21)14-19;12-11-8-10(6-7-13-11)9-4-2-1-3-5-9;7-6-4-2-1-3-5-6;;;/h3-22H,1-2H3;3-20H,1-2H3;3-14,24H,1-2H3;1-8H;1-5H;;;/q;-2;;;;;;+2
InChIKeySBROPROELXIXBB-UHFFFAOYSA-N
MW2051.54 g/mol
LogP27.73
Rot. Bonds15

About 2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+)

2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+) (PubChem CID 157417856) has the molecular formula C108H82ClN13O4Pt2 and a molecular weight of 2051.54 g/mol. Its IUPAC name is 2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+).

Molecular Properties

Compound Name2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+)
PubChem CID157417856
Molecular FormulaC108H82ClN13O4Pt2
Molecular Weight2051.54 g/mol
Exact Mass2049.56
IUPAC Name2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+)
SMILESCc1cc(C)n(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(-c4ccccc4)ccn3)ccc2)n1.Cc1cc(C)n(-c2cccc(Oc3ccc4c(c3)[nH]c3ccccc34)c2)n1.Cc1cc(C)n(-c2cccc(Oc3ccc4c5ccccc5n(-c5cc(-c6ccccc6)ccn5)c4c3)c2)n1.Clc1cc(-c2ccccc2)ccn1.O=[Pt]=Nc1ccccc1.[Pt+2]
InChIInChI=1S/C34H26N4O.C34H24N4O.C23H19N3O.C11H8ClN.C6H5N.O.2Pt/c2*1-23-19-24(2)38(36-23)27-11-8-12-28(21-27)39-29-15-16-31-30-13-6-7-14-32(30)37(33(31)22-29)34-20-26(17-18-35-34)25-9-4-3-5-10-25;1-15-12-16(2)26(25-15)17-6-5-7-18(13-17)27-19-10-11-21-20-8-3-4-9-22(20)24-23(21)14-19;12-11-8-10(6-7-13-11)9-4-2-1-3-5-9;7-6-4-2-1-3-5-6;;;/h3-22H,1-2H3;3-20H,1-2H3;3-14,24H,1-2H3;1-8H;1-5H;;;/q;-2;;;;;;+2
InChIKeySBROPROELXIXBB-UHFFFAOYSA-N
XLogP27.73
TPSA174.90 Ų
H-Bond Donors1
H-Bond Acceptors16
Rotatable Bonds15
Heavy Atoms128
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002051.54
LogP ≤ 527.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+)?
The IUPAC name of 2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+) (CID 157417856) is 2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+).
What is the SMILES notation for 2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+)?
The canonical SMILES for 2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+) is Cc1cc(C)n(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(-c4ccccc4)ccn3)ccc2)n1.Cc1cc(C)n(-c2cccc(Oc3ccc4c(c3)[nH]c3ccccc34)c2)n1.Cc1cc(C)n(-c2cccc(Oc3ccc4c5ccccc5n(-c5cc(-c6ccccc6)ccn5)c4c3)c2)n1.Clc1cc(-c2ccccc2)ccn1.O=[Pt]=Nc1ccccc1.[Pt+2].
What is the InChIKey of 2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+)?
The InChIKey is SBROPROELXIXBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H26N4O.C34H24N4O.C23H19N3O.C11H8ClN.C6H5N.O.2Pt/c2*1-23-19-24(2)38(36-23)27-11-8-12-28(21-27)39-29-15-16-31-30-13-6-7-14-32(30)37(33(31)22-29)34-20-26(17-18-35-34)25-9-4-3-5-10-25;1-15-12-16(2)26(25-15)17-6-5-7-18(13-17)27-19-10-11-21-20-8-3-4-9-22(20)24-23(21)14-19;12-11-8-10(6-7-13-11)9-4-2-1-3-5-9;7-6-4-2-1-3-5-6;;;/h3-22H,1-2H3;3-20H,1-2H3;3-14,24H,1-2H3;1-8H;1-5H;;;/q;-2;;;;;;+2.
What are the key properties of 2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+)?
2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+) has a molecular weight of 2051.54 g/mol, XLogP of 27.73, 15 rotatable bonds, 1 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-phenylpyridine;2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole;oxo(phenylimino)platinum;platinum(2+) is sourced from PubChem (CID 157417856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).