10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole

C33H20N4O — CID 118317554

IUPAC10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole
SMILESc1ccc(-c2ccc(-c3nc(-n4c5ccccc5c5ccc6occc6c54)nc4ccccc34)cc2)nc1
InChIInChI=1S/C33H20N4O/c1-3-10-28-25(8-1)31(22-14-12-21(13-15-22)27-9-5-6-19-34-27)36-33(35-28)37-29-11-4-2-7-23(29)24-16-17-30-26(32(24)37)18-20-38-30/h1-20H
InChIKeyHTMSGKQAADSPMM-UHFFFAOYSA-N
MW488.55 g/mol
LogP8.20
Rot. Bonds3

About 10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole

10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole (PubChem CID 118317554) has the molecular formula C33H20N4O and a molecular weight of 488.55 g/mol. Its IUPAC name is 10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole.

Molecular Properties

Compound Name10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole
PubChem CID118317554
Molecular FormulaC33H20N4O
Molecular Weight488.55 g/mol
Exact Mass488.16
IUPAC Name10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole
SMILESc1ccc(-c2ccc(-c3nc(-n4c5ccccc5c5ccc6occc6c54)nc4ccccc34)cc2)nc1
InChIInChI=1S/C33H20N4O/c1-3-10-28-25(8-1)31(22-14-12-21(13-15-22)27-9-5-6-19-34-27)36-33(35-28)37-29-11-4-2-7-23(29)24-16-17-30-26(32(24)37)18-20-38-30/h1-20H
InChIKeyHTMSGKQAADSPMM-UHFFFAOYSA-N
XLogP8.20
TPSA56.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500488.55
LogP ≤ 58.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

19-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]-2,16-dioxa-9,19-diazaheptacyclo[15.10.1.03,8.09,28.010,15.018,26.020,25]octacosa-1(28),3,5,7,10,12,14,17,20,22,24,26-dodecaene
CID 155419303
12-(4-phenylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole
CID 126580317
16-[4-(4-phenylphenyl)quinazolin-2-yl]-12-pyridin-2-yl-12,16-diazahexacyclo[11.11.0.02,11.05,10.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 163802710
11-(4,6-diphenylquinazolin-2-yl)-9,16-dioxa-11-azapentacyclo[10.7.0.02,10.03,8.013,17]nonadeca-1(12),2(10),3,5,7,13(17),14,18-octaene
CID 163481081
15-phenyl-18-(4-phenylquinazolin-2-yl)-12-oxa-15,18-diazaheptacyclo[14.11.0.02,14.05,13.06,11.017,25.019,24]heptacosa-1(16),2(14),3,5(13),6,8,10,17(25),19,21,23,26-dodecaene
CID 126679145
12-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaene
CID 139362309
24-[4-(4-phenylphenyl)quinazolin-2-yl]-24-azahexacyclo[12.11.0.02,11.05,10.017,25.018,23]pentacosa-1(14),2(11),3,5,7,9,12,15,17(25),18,20,22-dodecaene
CID 121432163
12-phenyl-15-[4-(4-phenylphenyl)quinazolin-2-yl]-24-oxa-12,15-diazaheptacyclo[14.11.0.02,14.05,13.06,11.017,25.018,23]heptacosa-1(16),2(14),3,5(13),6,8,10,17(25),18,20,22,26-dodecaene
CID 126679655
20-phenyl-9-[4-(4-phenylphenyl)quinazolin-2-yl]-7,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene
CID 138639873
3-(9-phenylcarbazol-3-yl)-12-(4-phenylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole
CID 90050449
2-dibenzofuran-2-yl-9-[4-[4-(4-phenylphenyl)phenyl]quinazolin-2-yl]carbazole
CID 90129211
5-[11-(4-dibenzofuran-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-11-phenylbenzo[a]carbazole
CID 134353213

Frequently Asked Questions

What is the IUPAC name of 10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole?
The IUPAC name of 10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole (CID 118317554) is 10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole.
What is the SMILES notation for 10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole?
The canonical SMILES for 10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole is c1ccc(-c2ccc(-c3nc(-n4c5ccccc5c5ccc6occc6c54)nc4ccccc34)cc2)nc1.
What is the InChIKey of 10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole?
The InChIKey is HTMSGKQAADSPMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H20N4O/c1-3-10-28-25(8-1)31(22-14-12-21(13-15-22)27-9-5-6-19-34-27)36-33(35-28)37-29-11-4-2-7-23(29)24-16-17-30-26(32(24)37)18-20-38-30/h1-20H.
What are the key properties of 10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole?
10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole has a molecular weight of 488.55 g/mol, XLogP of 8.20, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[4-(4-pyridin-2-ylphenyl)quinazolin-2-yl]furo[3,2-a]carbazole is sourced from PubChem (CID 118317554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).