N-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine

C61H45GeN3O — CID 140704741

IUPACN-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine
SMILESCOc1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2ccc3c(c2)c2cc([Ge](c4ccccc4)(c4ccccc4)c4ccccc4)ccc2n3-c2ccccc2)cc1
InChIInChI=1S/C61H45GeN3O/c1-66-53-36-32-50(33-37-53)63(51-34-39-60-56(42-51)54-29-17-18-30-58(54)64(60)48-25-13-5-14-26-48)52-35-40-61-57(43-52)55-41-47(31-38-59(55)65(61)49-27-15-6-16-28-49)62(44-19-7-2-8-20-44,45-21-9-3-10-22-45)46-23-11-4-12-24-46/h2-43H,1H3
InChIKeyCFMDCRHODVXXTK-UHFFFAOYSA-N
MW908.66 g/mol
LogP12.74
Rot. Bonds10

About N-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine

N-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine (PubChem CID 140704741) has the molecular formula C61H45GeN3O and a molecular weight of 908.66 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine
PubChem CID140704741
Molecular FormulaC61H45GeN3O
Molecular Weight908.66 g/mol
Exact Mass909.28
IUPAC NameN-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine
SMILESCOc1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2ccc3c(c2)c2cc([Ge](c4ccccc4)(c4ccccc4)c4ccccc4)ccc2n3-c2ccccc2)cc1
InChIInChI=1S/C61H45GeN3O/c1-66-53-36-32-50(33-37-53)63(51-34-39-60-56(42-51)54-29-17-18-30-58(54)64(60)48-25-13-5-14-26-48)52-35-40-61-57(43-52)55-41-47(31-38-59(55)65(61)49-27-15-6-16-28-49)62(44-19-7-2-8-20-44,45-21-9-3-10-22-45)46-23-11-4-12-24-46/h2-43H,1H3
InChIKeyCFMDCRHODVXXTK-UHFFFAOYSA-N
XLogP12.74
TPSA22.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms66
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500908.66
LogP ≤ 512.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine?
The IUPAC name of N-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine (CID 140704741) is N-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine.
What is the SMILES notation for N-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine?
The canonical SMILES for N-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine is COc1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2ccc3c(c2)c2cc([Ge](c4ccccc4)(c4ccccc4)c4ccccc4)ccc2n3-c2ccccc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine?
The InChIKey is CFMDCRHODVXXTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H45GeN3O/c1-66-53-36-32-50(33-37-53)63(51-34-39-60-56(42-51)54-29-17-18-30-58(54)64(60)48-25-13-5-14-26-48)52-35-40-61-57(43-52)55-41-47(31-38-59(55)65(61)49-27-15-6-16-28-49)62(44-19-7-2-8-20-44,45-21-9-3-10-22-45)46-23-11-4-12-24-46/h2-43H,1H3.
What are the key properties of N-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine?
N-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine has a molecular weight of 908.66 g/mol, XLogP of 12.74, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-9-phenyl-N-(9-phenylcarbazol-3-yl)-6-triphenylgermylcarbazol-3-amine is sourced from PubChem (CID 140704741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).