[4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane

C34H36GeN2O — CID 170931400

IUPAC[4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane
SMILESCC(C)c1cc([Ge](C)(C)C)cc(C(C)C)c1-n1c(-c2cccc3c2oc2ccccc23)nc2ccccc21
InChIInChI=1S/C34H36GeN2O/c1-21(2)27-19-23(35(5,6)7)20-28(22(3)4)32(27)37-30-17-10-9-16-29(30)36-34(37)26-15-12-14-25-24-13-8-11-18-31(24)38-33(25)26/h8-22H,1-7H3
InChIKeyHTZIACQNASOFGD-UHFFFAOYSA-N
MW561.29 g/mol
LogP9.38
Rot. Bonds5

About [4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane

[4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane (PubChem CID 170931400) has the molecular formula C34H36GeN2O and a molecular weight of 561.29 g/mol. Its IUPAC name is [4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane.

Molecular Properties

Compound Name[4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane
PubChem CID170931400
Molecular FormulaC34H36GeN2O
Molecular Weight561.29 g/mol
Exact Mass562.20
IUPAC Name[4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane
SMILESCC(C)c1cc([Ge](C)(C)C)cc(C(C)C)c1-n1c(-c2cccc3c2oc2ccccc23)nc2ccccc21
InChIInChI=1S/C34H36GeN2O/c1-21(2)27-19-23(35(5,6)7)20-28(22(3)4)32(27)37-30-17-10-9-16-29(30)36-34(37)26-15-12-14-25-24-13-8-11-18-31(24)38-33(25)26/h8-22H,1-7H3
InChIKeyHTZIACQNASOFGD-UHFFFAOYSA-N
XLogP9.38
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500561.29
LogP ≤ 59.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-dibenzofuran-4-yl-1-(2-phenyl-6-propan-2-ylphenyl)benzimidazole
CID 167356370
1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-(7-propan-2-yldibenzofuran-4-yl)benzimidazole
CID 156659271
1-[4-(4-phenylphenyl)-2,6-di(propan-2-yl)phenyl]-2-(7-propan-2-yldibenzofuran-4-yl)benzimidazole
CID 167388071
1-[2,6-di(propan-2-yl)phenyl]-2-(7-phenyldibenzofuran-4-yl)benzimidazole
CID 162776703
[6-[1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]dibenzofuran-3-yl]-trimethylsilane
CID 170931382
trimethyl-[4-[4-(2-naphtho[1,2-b][1]benzofuran-10-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]phenyl]germane
CID 168743438
2-[7-(2-deuteriopropan-2-yl)dibenzofuran-4-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazole
CID 176751448
2-[7-(2-deuteriopropan-2-yl)dibenzofuran-4-yl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole
CID 156657595
1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-(10-oxapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4(9),5,7,12,14,16,18,20-decaen-8-yl)benzimidazole
CID 156657597
1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-(10,14,21-trioxapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4(9),5,7,11,15,17,19-nonaen-8-yl)benzimidazole
CID 168799242
2-(21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-19-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole
CID 171461671
trimethyl-[4-(2-naphtho[1,2-b][1]benzofuran-10-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]silane
CID 176583988

Frequently Asked Questions

What is the IUPAC name of [4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane?
The IUPAC name of [4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane (CID 170931400) is [4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane.
What is the SMILES notation for [4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane?
The canonical SMILES for [4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane is CC(C)c1cc([Ge](C)(C)C)cc(C(C)C)c1-n1c(-c2cccc3c2oc2ccccc23)nc2ccccc21.
What is the InChIKey of [4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane?
The InChIKey is HTZIACQNASOFGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H36GeN2O/c1-21(2)27-19-23(35(5,6)7)20-28(22(3)4)32(27)37-30-17-10-9-16-29(30)36-34(37)26-15-12-14-25-24-13-8-11-18-31(24)38-33(25)26/h8-22H,1-7H3.
What are the key properties of [4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane?
[4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane has a molecular weight of 561.29 g/mol, XLogP of 9.38, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-dibenzofuran-4-ylbenzimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-trimethylgermane is sourced from PubChem (CID 170931400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).