10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole

C20H12BrNO — CID 174284299

IUPAC10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole
SMILESBrc1ccccc1-n1c2ccccc2c2oc3ccccc3c21
InChIInChI=1S/C20H12BrNO/c21-15-9-3-5-11-17(15)22-16-10-4-1-7-13(16)20-19(22)14-8-2-6-12-18(14)23-20/h1-12H
InChIKeyIHOTYYNJALZNPN-UHFFFAOYSA-N
MW362.23 g/mol
LogP6.29
Rot. Bonds1

About 10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole

10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole (PubChem CID 174284299) has the molecular formula C20H12BrNO and a molecular weight of 362.23 g/mol. Its IUPAC name is 10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole.

Molecular Properties

Compound Name10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole
PubChem CID174284299
Molecular FormulaC20H12BrNO
Molecular Weight362.23 g/mol
Exact Mass361.01
IUPAC Name10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole
SMILESBrc1ccccc1-n1c2ccccc2c2oc3ccccc3c21
InChIInChI=1S/C20H12BrNO/c21-15-9-3-5-11-17(15)22-16-10-4-1-7-13(16)20-19(22)14-8-2-6-12-18(14)23-20/h1-12H
InChIKeyIHOTYYNJALZNPN-UHFFFAOYSA-N
XLogP6.29
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.23
LogP ≤ 56.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

10-(3-bromophenyl)-[1]benzofuro[3,2-b]indole
CID 176780467
10-(3-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]indole
CID 121298634
12-(4-bromophenyl)-[1]benzofuro[2,3-a]carbazole
CID 129291278
12-dibenzofuran-4-yl-18-phenyl-15-oxa-12,18-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 121369237
11-phenyl-3,19-dioxa-11-azapentacyclo[10.7.0.02,10.04,9.013,18]nonadeca-1(12),2(10),4,6,8,13,15,17-octaene
CID 143805499
12-(2-dibenzofuran-2-ylphenyl)-[1]benzofuro[2,3-a]carbazole
CID 171612094
12-[6,10-bis([1]benzofuro[2,3-a]carbazol-12-yl)triphenylen-2-yl]-[1]benzofuro[2,3-a]carbazole
CID 122548582
9-oxa-1,18-diazahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-2(10),3,5,7,11,13,15,17,19,21,23-undecaene
CID 129128192
2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole
CID 118505930
12-(9-pyrimidin-2-ylcarbazol-4-yl)-[1]benzofuro[2,3-a]carbazole
CID 118502599
12-[3-[1-(3,5-diphenyl-1,2,4-triazol-4-yl)carbazol-9-yl]phenyl]-[1]benzofuro[2,3-a]carbazole
CID 146227203
12-pyridin-4-yl-[1]benzofuro[2,3-a]carbazole
CID 118502561

Frequently Asked Questions

What is the IUPAC name of 10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole?
The IUPAC name of 10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole (CID 174284299) is 10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole.
What is the SMILES notation for 10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole?
The canonical SMILES for 10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole is Brc1ccccc1-n1c2ccccc2c2oc3ccccc3c21.
What is the InChIKey of 10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole?
The InChIKey is IHOTYYNJALZNPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12BrNO/c21-15-9-3-5-11-17(15)22-16-10-4-1-7-13(16)20-19(22)14-8-2-6-12-18(14)23-20/h1-12H.
What are the key properties of 10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole?
10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole has a molecular weight of 362.23 g/mol, XLogP of 6.29, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(2-bromophenyl)-[1]benzofuro[3,2-b]indole is sourced from PubChem (CID 174284299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).