3-(3-bromophenyl)-9,9,10-triphenylacridine

C37H26BrN — CID 121259219

IUPAC3-(3-bromophenyl)-9,9,10-triphenylacridine
SMILESBrc1cccc(-c2ccc3c(c2)N(c2ccccc2)c2ccccc2C3(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C37H26BrN/c38-31-18-12-13-27(25-31)28-23-24-34-36(26-28)39(32-19-8-3-9-20-32)35-22-11-10-21-33(35)37(34,29-14-4-1-5-15-29)30-16-6-2-7-17-30/h1-26H
InChIKeyFWWSKRSFUIXCJS-UHFFFAOYSA-N
MW564.53 g/mol
LogP10.28
Rot. Bonds4

About 3-(3-bromophenyl)-9,9,10-triphenylacridine

3-(3-bromophenyl)-9,9,10-triphenylacridine (PubChem CID 121259219) has the molecular formula C37H26BrN and a molecular weight of 564.53 g/mol. Its IUPAC name is 3-(3-bromophenyl)-9,9,10-triphenylacridine.

Molecular Properties

Compound Name3-(3-bromophenyl)-9,9,10-triphenylacridine
PubChem CID121259219
Molecular FormulaC37H26BrN
Molecular Weight564.53 g/mol
Exact Mass563.12
IUPAC Name3-(3-bromophenyl)-9,9,10-triphenylacridine
SMILESBrc1cccc(-c2ccc3c(c2)N(c2ccccc2)c2ccccc2C3(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C37H26BrN/c38-31-18-12-13-27(25-31)28-23-24-34-36(26-28)39(32-19-8-3-9-20-32)35-22-11-10-21-33(35)37(34,29-14-4-1-5-15-29)30-16-6-2-7-17-30/h1-26H
InChIKeyFWWSKRSFUIXCJS-UHFFFAOYSA-N
XLogP10.28
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500564.53
LogP ≤ 510.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-(3-bromophenyl)-9,9,10-triphenylacridine 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

10-[4-[3-[3-[4-(9,9-diphenylacridin-10-yl)phenyl]phenyl]phenyl]phenyl]-9,9-diphenylacridine
CID 59470076
N,4-diphenyl-N-[4-(9,9,10-triphenylacridin-3-yl)phenyl]aniline
CID 121259178
4,8,8,14,14,18-hexakis-phenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene
CID 140932144
10-[4-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine
CID 59399598
3-(9,9-dimethyl-10-phenylacridin-3-yl)-9,9-dimethyl-10-phenylacridine
CID 58489784
9-(3-bromophenyl)-10-(4,6-diphenylpyrimidin-2-yl)-9-phenylacridine
CID 118232016
2-phenyl-10,10'-bis(4-phenylphenyl)-9,9'-spirobi[acridine]
CID 118465104
11,11,16,21,21-pentakis-phenyl-4,16,28-triaza-1λ5-phosphadecacyclo[18.14.2.02,15.03,12.04,33.05,10.017,35.022,27.028,36.029,34]hexatriaconta-2(15),3(12),5,7,9,13,17(35),18,20(36),22,24,26,29,31,33-pentadecaene 1-oxide
CID 134317366
N-(9,9-diphenylfluoren-2-yl)-1,13-diphenyl-N-(3-phenylphenyl)-13-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-amine
CID 168750647
9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine
CID 121259026
10-phenyl-3-pyridin-4-ylspiro[acridine-9,9'-fluorene]
CID 146495033
N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-[4-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
CID 155240909

Frequently Asked Questions

What is the IUPAC name of 3-(3-bromophenyl)-9,9,10-triphenylacridine?
The IUPAC name of 3-(3-bromophenyl)-9,9,10-triphenylacridine (CID 121259219) is 3-(3-bromophenyl)-9,9,10-triphenylacridine.
What is the SMILES notation for 3-(3-bromophenyl)-9,9,10-triphenylacridine?
The canonical SMILES for 3-(3-bromophenyl)-9,9,10-triphenylacridine is Brc1cccc(-c2ccc3c(c2)N(c2ccccc2)c2ccccc2C3(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of 3-(3-bromophenyl)-9,9,10-triphenylacridine?
The InChIKey is FWWSKRSFUIXCJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H26BrN/c38-31-18-12-13-27(25-31)28-23-24-34-36(26-28)39(32-19-8-3-9-20-32)35-22-11-10-21-33(35)37(34,29-14-4-1-5-15-29)30-16-6-2-7-17-30/h1-26H.
What are the key properties of 3-(3-bromophenyl)-9,9,10-triphenylacridine?
3-(3-bromophenyl)-9,9,10-triphenylacridine has a molecular weight of 564.53 g/mol, XLogP of 10.28, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-bromophenyl)-9,9,10-triphenylacridine is sourced from PubChem (CID 121259219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).