2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum

C21H15N3O2Pt — CID 135961556

IUPAC2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum
SMILESOc1ccccc1-c1cccc(-c2ccnc(-c3ccccc3O)n2)n1.[Pt]
InChIInChI=1S/C21H15N3O2.Pt/c25-19-10-3-1-6-14(19)16-8-5-9-17(23-16)18-12-13-22-21(24-18)15-7-2-4-11-20(15)26;/h1-13,25-26H;
InChIKeyNVKCHRIVIVQQEG-UHFFFAOYSA-N
MW536.45 g/mol
LogP4.28
Rot. Bonds3

About 2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum

2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum (PubChem CID 135961556) has the molecular formula C21H15N3O2Pt and a molecular weight of 536.45 g/mol. Its IUPAC name is 2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum.

Molecular Properties

Compound Name2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum
PubChem CID135961556
Molecular FormulaC21H15N3O2Pt
Molecular Weight536.45 g/mol
Exact Mass536.08
IUPAC Name2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum
SMILESOc1ccccc1-c1cccc(-c2ccnc(-c3ccccc3O)n2)n1.[Pt]
InChIInChI=1S/C21H15N3O2.Pt/c25-19-10-3-1-6-14(19)16-8-5-9-17(23-16)18-12-13-22-21(24-18)15-7-2-4-11-20(15)26;/h1-13,25-26H;
InChIKeyNVKCHRIVIVQQEG-UHFFFAOYSA-N
XLogP4.28
TPSA79.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500536.45
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-{4-[(Pyridin-3-ylmethyl)-amino]-quinazolin-2-yl}-phenol
CID 935994
2-(1,8-Naphthyridin-2-yl)phenol
CID 2761113
3-(2-morpholino-7-(pyridin-3-yl)-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)phenol
CID 24888918
4-(3-ethenyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-(4-methyl-2-propan-2-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2-one
CID 163795638
4-(3-ethenyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-propan-2-ylpyrido[2,3-d]pyrimidin-2-one
CID 164054598
2-allyl-6-{(E)-[(2-phenylimidazo[1,2-a]pyridin-8-yl)imino]methyl}phenol
CID 5179799
2-[2-Amino-5-(1-ethylpyrrolo[2,3-b]pyridin-5-yl)pyrimidin-4-yl]phenol
CID 136000659
N-(3-ethylphenyl)-4-(2-hydroxyphenyl)-2-(pyridin-3-yl)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxamide
CID 136088963
2-({3-[5-(2-Methylphenyl)-2-(4-pyridinyl)-4-pyrimidinyl]-1-piperidinyl}methyl)phenol
CID 45166660
2-[2-Methyl-1-(1-methylpiperidin-4-yl)imidazo[4,5-c]quinolin-8-yl]phenol
CID 168284340
2-[(4-Quinazolin-4-ylpiperazin-1-yl)methyl]phenol
CID 71508231
2-(4-Morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol
CID 136245085

Frequently Asked Questions

What is the IUPAC name of 2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum?
The IUPAC name of 2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum (CID 135961556) is 2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum.
What is the SMILES notation for 2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum?
The canonical SMILES for 2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum is Oc1ccccc1-c1cccc(-c2ccnc(-c3ccccc3O)n2)n1.[Pt].
What is the InChIKey of 2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum?
The InChIKey is NVKCHRIVIVQQEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15N3O2.Pt/c25-19-10-3-1-6-14(19)16-8-5-9-17(23-16)18-12-13-22-21(24-18)15-7-2-4-11-20(15)26;/h1-13,25-26H;.
What are the key properties of 2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum?
2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum has a molecular weight of 536.45 g/mol, XLogP of 4.28, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[2-(2-hydroxyphenyl)pyrimidin-4-yl]-2-pyridinyl]phenol;platinum is sourced from PubChem (CID 135961556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).