12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole

C42H23N3O2 — CID 156564433

IUPAC12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole
SMILESc1ccc2c(c1)ccc1c3cccc(-c4nc(-n5c6ccccc6c6ccc7c8ccccc8oc7c65)nc5ccccc45)c3oc21
InChIInChI=1S/C42H23N3O2/c1-2-11-25-24(10-1)20-21-31-29-15-9-16-33(40(29)47-39(25)31)37-32-14-3-6-17-34(32)43-42(44-37)45-35-18-7-4-12-26(35)28-22-23-30-27-13-5-8-19-36(27)46-41(30)38(28)45/h1-23H
InChIKeyOLEMBZIRBHQKMT-UHFFFAOYSA-N
MW601.67 g/mol
LogP11.35
Rot. Bonds2

About 12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole

12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole (PubChem CID 156564433) has the molecular formula C42H23N3O2 and a molecular weight of 601.67 g/mol. Its IUPAC name is 12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole.

Molecular Properties

Compound Name12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole
PubChem CID156564433
Molecular FormulaC42H23N3O2
Molecular Weight601.67 g/mol
Exact Mass601.18
IUPAC Name12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole
SMILESc1ccc2c(c1)ccc1c3cccc(-c4nc(-n5c6ccccc6c6ccc7c8ccccc8oc7c65)nc5ccccc45)c3oc21
InChIInChI=1S/C42H23N3O2/c1-2-11-25-24(10-1)20-21-31-29-15-9-16-33(40(29)47-39(25)31)37-32-14-3-6-17-34(32)43-42(44-37)45-35-18-7-4-12-26(35)28-22-23-30-27-13-5-8-19-36(27)46-41(30)38(28)45/h1-23H
InChIKeyOLEMBZIRBHQKMT-UHFFFAOYSA-N
XLogP11.35
TPSA56.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500601.67
LogP ≤ 511.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

12-(4-phenylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole
CID 126580317
12-(4-dibenzofuran-4-ylquinazolin-2-yl)-[1]benzothiolo[3,2-a]carbazole
CID 71291213
26-(4-dibenzofuran-4-ylquinazolin-2-yl)-14,26-diazaheptacyclo[12.10.1.13,24.02,7.08,13.015,20.021,25]hexacosa-1(24),2(7),3,5,8,10,12,15,17,19,21(25),22-dodecaene
CID 139570649
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
9-carbazol-9-yl-5-(4-dibenzofuran-4-ylquinazolin-2-yl)benzo[b]carbazole
CID 146374848
10-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-11-(4-phenylquinazolin-2-yl)benzo[a]carbazole
CID 142568640
12-(13-phenyl-11-oxa-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaen-15-yl)-[1]benzofuro[2,3-a]carbazole
CID 170371290
5-dibenzofuran-4-yl-12-(4-phenylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole
CID 134252440
9-benzo[c]carbazol-7-yl-7-(4-dibenzofuran-4-ylquinazolin-2-yl)benzo[c]carbazole;9-benzo[c]carbazol-7-yl-7-(3-dibenzofuran-4-ylquinoxalin-2-yl)benzo[c]carbazole;9-carbazol-9-yl-7-(4-dibenzofuran-4-ylquinazolin-2-yl)benzo[c]carbazole;9-carbazol-9-yl-7-(3-dibenzofuran-4-ylquinoxalin-2-yl)benzo[c]carbazole
CID 163669250
3-dibenzofuran-4-yl-9-(4-dibenzofuran-1-ylquinazolin-2-yl)carbazole
CID 130327449
4-dibenzofuran-4-yl-5-(4-phenylquinazolin-2-yl)benzo[b]carbazole
CID 142570823
4-dibenzofuran-4-yl-5-[4-(4-naphthalen-1-ylphenyl)quinazolin-2-yl]benzo[b]carbazole
CID 142570275

Frequently Asked Questions

What is the IUPAC name of 12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole?
The IUPAC name of 12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole (CID 156564433) is 12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole.
What is the SMILES notation for 12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole?
The canonical SMILES for 12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole is c1ccc2c(c1)ccc1c3cccc(-c4nc(-n5c6ccccc6c6ccc7c8ccccc8oc7c65)nc5ccccc45)c3oc21.
What is the InChIKey of 12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole?
The InChIKey is OLEMBZIRBHQKMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H23N3O2/c1-2-11-25-24(10-1)20-21-31-29-15-9-16-33(40(29)47-39(25)31)37-32-14-3-6-17-34(32)43-42(44-37)45-35-18-7-4-12-26(35)28-22-23-30-27-13-5-8-19-36(27)46-41(30)38(28)45/h1-23H.
What are the key properties of 12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole?
12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole has a molecular weight of 601.67 g/mol, XLogP of 11.35, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 12-(4-naphtho[1,2-b][1]benzofuran-10-ylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole is sourced from PubChem (CID 156564433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).