2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one

C122H78N14O7 — CID 157300729

IUPAC2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one
SMILESO=c1c2ccccc2nc(-c2cc(-c3ccccc3)cc(-c3nc4ccccc4c(=O)n3-c3ccccc3)c2)n1-c1ccccc1.O=c1c2ccccc2nc(-c2cc(-c3nc4ccccc4c(=O)n3-c3ccccc3)cc(-c3nc4ccccc4c(=O)n3-c3ccccc3)c2)n1-c1ccccc1.O=c1c2ccccc2nc(-c2cccc(-c3nc4ccccc4c(=O)n3-c3ccccc3)c2)n1-c1ccccc1
InChIInChI=1S/C48H30N6O3.C40H26N4O2.C34H22N4O2/c55-46-37-22-10-13-25-40(37)49-43(52(46)34-16-4-1-5-17-34)31-28-32(44-50-41-26-14-11-23-38(41)47(56)53(44)35-18-6-2-7-19-35)30-33(29-31)45-51-42-27-15-12-24-39(42)48(57)54(45)36-20-8-3-9-21-36;45-39-33-20-10-12-22-35(33)41-37(43(39)31-16-6-2-7-17-31)29-24-28(27-14-4-1-5-15-27)25-30(26-29)38-42-36-23-13-11-21-34(36)40(46)44(38)32-18-8-3-9-19-32;39-33-27-18-7-9-20-29(27)35-31(37(33)25-14-3-1-4-15-25)23-12-11-13-24(22-23)32-36-30-21-10-8-19-28(30)34(40)38(32)26-16-5-2-6-17-26/h1-30H;1-26H;1-22H
InChIKeyBBWFFLPAGKKZJI-UHFFFAOYSA-N
MW1852.06 g/mol
LogP23.29
Rot. Bonds15

About 2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one

2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one (PubChem CID 157300729) has the molecular formula C122H78N14O7 and a molecular weight of 1852.06 g/mol. Its IUPAC name is 2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one.

Molecular Properties

Compound Name2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one
PubChem CID157300729
Molecular FormulaC122H78N14O7
Molecular Weight1852.06 g/mol
Exact Mass1850.62
IUPAC Name2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one
SMILESO=c1c2ccccc2nc(-c2cc(-c3ccccc3)cc(-c3nc4ccccc4c(=O)n3-c3ccccc3)c2)n1-c1ccccc1.O=c1c2ccccc2nc(-c2cc(-c3nc4ccccc4c(=O)n3-c3ccccc3)cc(-c3nc4ccccc4c(=O)n3-c3ccccc3)c2)n1-c1ccccc1.O=c1c2ccccc2nc(-c2cccc(-c3nc4ccccc4c(=O)n3-c3ccccc3)c2)n1-c1ccccc1
InChIInChI=1S/C48H30N6O3.C40H26N4O2.C34H22N4O2/c55-46-37-22-10-13-25-40(37)49-43(52(46)34-16-4-1-5-17-34)31-28-32(44-50-41-26-14-11-23-38(41)47(56)53(44)35-18-6-2-7-19-35)30-33(29-31)45-51-42-27-15-12-24-39(42)48(57)54(45)36-20-8-3-9-21-36;45-39-33-20-10-12-22-35(33)41-37(43(39)31-16-6-2-7-17-31)29-24-28(27-14-4-1-5-15-27)25-30(26-29)38-42-36-23-13-11-21-34(36)40(46)44(38)32-18-8-3-9-19-32;39-33-27-18-7-9-20-29(27)35-31(37(33)25-14-3-1-4-15-25)23-12-11-13-24(22-23)32-36-30-21-10-8-19-28(30)34(40)38(32)26-16-5-2-6-17-26/h1-30H;1-26H;1-22H
InChIKeyBBWFFLPAGKKZJI-UHFFFAOYSA-N
XLogP23.29
TPSA244.23 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds15
Heavy Atoms143
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001852.06
LogP ≤ 523.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze 2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one with MolForge

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Related Compounds

2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one
CID 121247434
ethane;2-(3-methylphenyl)-3-phenylquinazolin-4-one
CID 142888475
3-[3,5-bis(4-oxo-2-phenylquinazolin-3-yl)phenyl]-2-phenylquinazolin-4-one
CID 121247436
2-(4-phenylphenyl)-3-pyridin-4-ylquinazolin-4-one
CID 1047183
3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-phenylquinazolin-4-one
CID 121247655
3-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]quinazolin-4-one
CID 121247662
2-phenyl-3-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]quinazolin-4-one
CID 121247295
3-(4-methoxyphenyl)-2-phenylquinazolin-4-one
CID 708934
3-(3-hydroxyphenyl)-2-(4-methylphenyl)quinazolin-4-one
CID 717898
2-(1,3-diphenylpyrazol-5-yl)-3-phenylquinazolin-4-one
CID 102437700
2,3-bis[3-(4-phenylquinazolin-2-yl)phenyl]quinazolin-4-one;2-phenyl-3-[4-(2-phenylbenzimidazol-1-yl)phenyl]quinazolin-4-one;3-phenyl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]quinazolin-4-one
CID 159155859
2,3-bis(4-bromophenyl)quinazolin-4-one
CID 3707353

Frequently Asked Questions

What is the IUPAC name of 2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one?
The IUPAC name of 2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one (CID 157300729) is 2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one.
What is the SMILES notation for 2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one?
The canonical SMILES for 2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one is O=c1c2ccccc2nc(-c2cc(-c3ccccc3)cc(-c3nc4ccccc4c(=O)n3-c3ccccc3)c2)n1-c1ccccc1.O=c1c2ccccc2nc(-c2cc(-c3nc4ccccc4c(=O)n3-c3ccccc3)cc(-c3nc4ccccc4c(=O)n3-c3ccccc3)c2)n1-c1ccccc1.O=c1c2ccccc2nc(-c2cccc(-c3nc4ccccc4c(=O)n3-c3ccccc3)c2)n1-c1ccccc1.
What is the InChIKey of 2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one?
The InChIKey is BBWFFLPAGKKZJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N6O3.C40H26N4O2.C34H22N4O2/c55-46-37-22-10-13-25-40(37)49-43(52(46)34-16-4-1-5-17-34)31-28-32(44-50-41-26-14-11-23-38(41)47(56)53(44)35-18-6-2-7-19-35)30-33(29-31)45-51-42-27-15-12-24-39(42)48(57)54(45)36-20-8-3-9-21-36;45-39-33-20-10-12-22-35(33)41-37(43(39)31-16-6-2-7-17-31)29-24-28(27-14-4-1-5-15-27)25-30(26-29)38-42-36-23-13-11-21-34(36)40(46)44(38)32-18-8-3-9-19-32;39-33-27-18-7-9-20-29(27)35-31(37(33)25-14-3-1-4-15-25)23-12-11-13-24(22-23)32-36-30-21-10-8-19-28(30)34(40)38(32)26-16-5-2-6-17-26/h1-30H;1-26H;1-22H.
What are the key properties of 2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one?
2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one has a molecular weight of 1852.06 g/mol, XLogP of 23.29, 15 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,5-bis(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one;2-[3-(4-oxo-3-phenylquinazolin-2-yl)phenyl]-3-phenylquinazolin-4-one is sourced from PubChem (CID 157300729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).