5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum

C37H28N4O2Pt — CID 176624877

IUPAC5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum
SMILESCC(C)(C)c1ccc2cc3ccc4c5ccc(O)c(-c6cccc(-c7cccc(-c8ccccn8)n7)n6)c5oc4n3c2c1.[Pt]
InChIInChI=1S/C37H28N4O2.Pt/c1-37(2,3)23-14-13-22-20-24-15-16-26-25-17-18-33(42)34(35(25)43-36(26)41(24)32(22)21-23)31-12-7-11-30(40-31)29-10-6-9-28(39-29)27-8-4-5-19-38-27;/h4-21,42H,1-3H3;
InChIKeyAHOHNEOZZBIOCL-UHFFFAOYSA-N
MW755.74 g/mol
LogP9.18
Rot. Bonds3

About 5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum

5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum (PubChem CID 176624877) has the molecular formula C37H28N4O2Pt and a molecular weight of 755.74 g/mol. Its IUPAC name is 5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum.

Molecular Properties

Compound Name5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum
PubChem CID176624877
Molecular FormulaC37H28N4O2Pt
Molecular Weight755.74 g/mol
Exact Mass755.19
IUPAC Name5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum
SMILESCC(C)(C)c1ccc2cc3ccc4c5ccc(O)c(-c6cccc(-c7cccc(-c8ccccn8)n7)n6)c5oc4n3c2c1.[Pt]
InChIInChI=1S/C37H28N4O2.Pt/c1-37(2,3)23-14-13-22-20-24-15-16-26-25-17-18-33(42)34(35(25)43-36(26)41(24)32(22)21-23)31-12-7-11-30(40-31)29-10-6-9-28(39-29)27-8-4-5-19-38-27;/h4-21,42H,1-3H3;
InChIKeyAHOHNEOZZBIOCL-UHFFFAOYSA-N
XLogP9.18
TPSA76.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500755.74
LogP ≤ 59.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum with MolForge

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Launch Full Analysis

Related Compounds

5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol
CID 176624878
2-(4-tert-butyl-2-pyridinyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine
CID 15827510
7-pyridin-2-yl-9-oxapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1(13),2(10),3(8),4,6,11,14,16,18,20-decaen-6-ol
CID 153291342
bis(21-pyridin-2-yl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-20-ol);zinc
CID 153291339
4-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]dibenzofuran-3-ol;platinum
CID 162783546
5-tert-butyl-18-[6-[2-(3-pyridin-2-ylphenyl)propan-2-yl]-2-pyridinyl]-20-oxa-2,9,11-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaene
CID 164709257
2-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)benzene-1,3-diol
CID 136711024
4-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]-6-phenyldibenzofuran-3-ol;platinum
CID 170543443
2-pyridin-2-yl-6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-4-[2-pyridin-2-yl-6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-4-pyridinyl]pyridine
CID 15448140
2-[6-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)benzo[a]tetracen-13-yl]-6-pyridin-2-ylpyridine
CID 89177926
2-[3,6-ditert-butyl-9-[4-(2,6-dimethylphenyl)-6-pyridin-2-yl-2-pyridinyl]carbazol-2-yl]phenol
CID 166511940
2-[6-(6-tert-butyl-9-pyridin-2-ylcarbazol-2-yl)-4-(3,5-ditert-butylphenyl)-2-pyridinyl]phenol
CID 136600896

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum?
The IUPAC name of 5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum (CID 176624877) is 5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum.
What is the SMILES notation for 5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum?
The canonical SMILES for 5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum is CC(C)(C)c1ccc2cc3ccc4c5ccc(O)c(-c6cccc(-c7cccc(-c8ccccn8)n7)n6)c5oc4n3c2c1.[Pt].
What is the InChIKey of 5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum?
The InChIKey is AHOHNEOZZBIOCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H28N4O2.Pt/c1-37(2,3)23-14-13-22-20-24-15-16-26-25-17-18-33(42)34(35(25)43-36(26)41(24)32(22)21-23)31-12-7-11-30(40-31)29-10-6-9-28(39-29)27-8-4-5-19-38-27;/h4-21,42H,1-3H3;.
What are the key properties of 5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum?
5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum has a molecular weight of 755.74 g/mol, XLogP of 9.18, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-18-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-20-oxa-2-azapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,9,11,14(19),15,17-nonaen-17-ol;platinum is sourced from PubChem (CID 176624877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).