N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine

C208H130N14O5S — CID 167556602

IUPACN-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine
SMILESc1ccc2cc(-c3ccc4cc(N(c5ccc(-c6cn7ccccc7n6)cc5)c5ccc(-c6cn7ccccc7n6)cc5)ccc4c3)ccc2c1.c1ccc2cc(-c3ccc4cc(N(c5ccc(-c6nc7cc8ccccc8cc7o6)cc5)c5ccc(-c6nc7cc8ccccc8cc7o6)cc5)ccc4c3)ccc2c1.c1ccc2cc(-c3ccc4cc(N(c5ccc(-c6nc7ccc8ccccc8c7o6)cc5)c5ccc(-c6nc7ccc8ccccc8c7o6)cc5)ccc4c3)ccc2c1.c1ccc2cc(-c3ccc4cc(N(c5ccc6cc(-c7nc8ccccc8o7)ccc6c5)c5ccc6cc(-c7nc8ccccc8s7)ccc6c5)ccc4c3)ccc2c1
InChIInChI=1S/2C54H33N3O2.C54H33N3OS.C46H31N5/c1-2-10-39-31-40(14-13-34(39)7-1)41-15-16-43-33-46(28-21-42(43)32-41)57(44-24-17-37(18-25-44)53-55-49-29-22-35-8-3-5-11-47(35)51(49)58-53)45-26-19-38(20-27-45)54-56-50-30-23-36-9-4-6-12-48(36)52(50)59-54;1-2-8-37-27-42(14-13-34(37)7-1)43-15-16-45-29-48(26-21-44(45)28-43)57(46-22-17-35(18-23-46)53-55-49-30-38-9-3-5-11-40(38)32-51(49)58-53)47-24-19-36(20-25-47)54-56-50-31-39-10-4-6-12-41(39)33-52(50)59-54;1-2-8-35-27-36(14-13-34(35)7-1)37-15-16-41-31-46(24-21-38(41)28-37)57(47-25-22-39-29-44(19-17-42(39)32-47)53-55-49-9-3-5-11-51(49)58-53)48-26-23-40-30-45(20-18-43(40)33-48)54-56-50-10-4-6-12-52(50)59-54;1-2-8-35-27-36(12-11-32(35)7-1)37-13-14-39-29-42(24-19-38(39)28-37)51(40-20-15-33(16-21-40)43-30-49-25-5-3-9-45(49)47-43)41-22-17-34(18-23-41)44-31-50-26-6-4-10-46(50)48-44/h3*1-33H;1-31H
InChIKeyDCBLYJNAORNPJV-UHFFFAOYSA-N
MW2937.49 g/mol
LogP57.39
Rot. Bonds24

About N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine

N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine (PubChem CID 167556602) has the molecular formula C208H130N14O5S and a molecular weight of 2937.49 g/mol. Its IUPAC name is N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine.

Molecular Properties

Compound NameN-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine
PubChem CID167556602
Molecular FormulaC208H130N14O5S
Molecular Weight2937.49 g/mol
Exact Mass2935.01
IUPAC NameN-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine
SMILESc1ccc2cc(-c3ccc4cc(N(c5ccc(-c6cn7ccccc7n6)cc5)c5ccc(-c6cn7ccccc7n6)cc5)ccc4c3)ccc2c1.c1ccc2cc(-c3ccc4cc(N(c5ccc(-c6nc7cc8ccccc8cc7o6)cc5)c5ccc(-c6nc7cc8ccccc8cc7o6)cc5)ccc4c3)ccc2c1.c1ccc2cc(-c3ccc4cc(N(c5ccc(-c6nc7ccc8ccccc8c7o6)cc5)c5ccc(-c6nc7ccc8ccccc8c7o6)cc5)ccc4c3)ccc2c1.c1ccc2cc(-c3ccc4cc(N(c5ccc6cc(-c7nc8ccccc8o7)ccc6c5)c5ccc6cc(-c7nc8ccccc8s7)ccc6c5)ccc4c3)ccc2c1
InChIInChI=1S/2C54H33N3O2.C54H33N3OS.C46H31N5/c1-2-10-39-31-40(14-13-34(39)7-1)41-15-16-43-33-46(28-21-42(43)32-41)57(44-24-17-37(18-25-44)53-55-49-29-22-35-8-3-5-11-47(35)51(49)58-53)45-26-19-38(20-27-45)54-56-50-30-23-36-9-4-6-12-48(36)52(50)59-54;1-2-8-37-27-42(14-13-34(37)7-1)43-15-16-45-29-48(26-21-44(45)28-43)57(46-22-17-35(18-23-46)53-55-49-30-38-9-3-5-11-40(38)32-51(49)58-53)47-24-19-36(20-25-47)54-56-50-31-39-10-4-6-12-41(39)33-52(50)59-54;1-2-8-35-27-36(14-13-34(35)7-1)37-15-16-41-31-46(24-21-38(41)28-37)57(47-25-22-39-29-44(19-17-42(39)32-47)53-55-49-9-3-5-11-51(49)58-53)48-26-23-40-30-45(20-18-43(40)33-48)54-56-50-10-4-6-12-52(50)59-54;1-2-8-35-27-36(12-11-32(35)7-1)37-13-14-39-29-42(24-19-38(39)28-37)51(40-20-15-33(16-21-40)43-30-49-25-5-3-9-45(49)47-43)41-22-17-34(18-23-41)44-31-50-26-6-4-10-46(50)48-44/h3*1-33H;1-31H
InChIKeyDCBLYJNAORNPJV-UHFFFAOYSA-N
XLogP57.39
TPSA190.60 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds24
Heavy Atoms228
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002937.49
LogP ≤ 557.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine?
The IUPAC name of N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine (CID 167556602) is N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine.
What is the SMILES notation for N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine?
The canonical SMILES for N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine is c1ccc2cc(-c3ccc4cc(N(c5ccc(-c6cn7ccccc7n6)cc5)c5ccc(-c6cn7ccccc7n6)cc5)ccc4c3)ccc2c1.c1ccc2cc(-c3ccc4cc(N(c5ccc(-c6nc7cc8ccccc8cc7o6)cc5)c5ccc(-c6nc7cc8ccccc8cc7o6)cc5)ccc4c3)ccc2c1.c1ccc2cc(-c3ccc4cc(N(c5ccc(-c6nc7ccc8ccccc8c7o6)cc5)c5ccc(-c6nc7ccc8ccccc8c7o6)cc5)ccc4c3)ccc2c1.c1ccc2cc(-c3ccc4cc(N(c5ccc6cc(-c7nc8ccccc8o7)ccc6c5)c5ccc6cc(-c7nc8ccccc8s7)ccc6c5)ccc4c3)ccc2c1.
What is the InChIKey of N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine?
The InChIKey is DCBLYJNAORNPJV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C54H33N3O2.C54H33N3OS.C46H31N5/c1-2-10-39-31-40(14-13-34(39)7-1)41-15-16-43-33-46(28-21-42(43)32-41)57(44-24-17-37(18-25-44)53-55-49-29-22-35-8-3-5-11-47(35)51(49)58-53)45-26-19-38(20-27-45)54-56-50-30-23-36-9-4-6-12-48(36)52(50)59-54;1-2-8-37-27-42(14-13-34(37)7-1)43-15-16-45-29-48(26-21-44(45)28-43)57(46-22-17-35(18-23-46)53-55-49-30-38-9-3-5-11-40(38)32-51(49)58-53)47-24-19-36(20-25-47)54-56-50-31-39-10-4-6-12-41(39)33-52(50)59-54;1-2-8-35-27-36(14-13-34(35)7-1)37-15-16-41-31-46(24-21-38(41)28-37)57(47-25-22-39-29-44(19-17-42(39)32-47)53-55-49-9-3-5-11-51(49)58-53)48-26-23-40-30-45(20-18-43(40)33-48)54-56-50-10-4-6-12-52(50)59-54;1-2-8-35-27-36(12-11-32(35)7-1)37-13-14-39-29-42(24-19-38(39)28-37)51(40-20-15-33(16-21-40)43-30-49-25-5-3-9-45(49)47-43)41-22-17-34(18-23-41)44-31-50-26-6-4-10-46(50)48-44/h3*1-33H;1-31H.
What are the key properties of N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine?
N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine has a molecular weight of 2937.49 g/mol, XLogP of 57.39, 24 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(1,3-benzothiazol-2-yl)naphthalen-2-yl]-N-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-benzo[g][1,3]benzoxazol-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-imidazo[1,2-a]pyridin-2-ylphenyl)-6-naphthalen-2-ylnaphthalen-2-amine is sourced from PubChem (CID 167556602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).