2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole

C172H112Br4N4 — CID 158627410

IUPAC2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole
SMILESBrc1cccc(-c2ccc3c4ccccc4n(-c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)c3c2)c1.Brc1cccc(-c2ccc3c4ccccc4n(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c3c2)c1.Brc1cccc(-c2ccc3c4ccccc4n(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)c3c2)c1.Brc1cccc(-c2ccc3c4ccccc4n(-c4cccc5c4C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c3c2)c1
InChIInChI=1S/4C43H28BrN/c44-33-18-11-13-29(27-33)30-25-26-35-34-19-8-10-23-39(34)45(41(35)28-30)40-24-12-22-38-42(40)36-20-7-9-21-37(36)43(38,31-14-3-1-4-15-31)32-16-5-2-6-17-32;44-33-18-11-13-29(27-33)30-25-26-36-35-20-8-10-23-39(35)45(41(36)28-30)40-24-12-21-37-34-19-7-9-22-38(34)43(42(37)40,31-14-3-1-4-15-31)32-16-5-2-6-17-32;44-33-17-11-12-29(26-33)30-22-24-38-37-19-8-10-21-41(37)45(42(38)27-30)34-23-25-36-35-18-7-9-20-39(35)43(40(36)28-34,31-13-3-1-4-14-31)32-15-5-2-6-16-32;44-33-17-11-12-29(26-33)30-22-24-37-36-19-8-10-21-41(36)45(42(37)27-30)34-23-25-40-38(28-34)35-18-7-9-20-39(35)43(40,31-13-3-1-4-14-31)32-15-5-2-6-16-32/h4*1-28H
InChIKeyHYTNXTMHWVGZNP-UHFFFAOYSA-N
MW2554.43 g/mol
LogP46.31
Rot. Bonds16

About 2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole

2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole (PubChem CID 158627410) has the molecular formula C172H112Br4N4 and a molecular weight of 2554.43 g/mol. Its IUPAC name is 2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole.

Molecular Properties

Compound Name2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole
PubChem CID158627410
Molecular FormulaC172H112Br4N4
Molecular Weight2554.43 g/mol
Exact Mass2548.56
IUPAC Name2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole
SMILESBrc1cccc(-c2ccc3c4ccccc4n(-c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)c3c2)c1.Brc1cccc(-c2ccc3c4ccccc4n(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c3c2)c1.Brc1cccc(-c2ccc3c4ccccc4n(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)c3c2)c1.Brc1cccc(-c2ccc3c4ccccc4n(-c4cccc5c4C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c3c2)c1
InChIInChI=1S/4C43H28BrN/c44-33-18-11-13-29(27-33)30-25-26-35-34-19-8-10-23-39(34)45(41(35)28-30)40-24-12-22-38-42(40)36-20-7-9-21-37(36)43(38,31-14-3-1-4-15-31)32-16-5-2-6-17-32;44-33-18-11-13-29(27-33)30-25-26-36-35-20-8-10-23-39(35)45(41(36)28-30)40-24-12-21-37-34-19-7-9-22-38(34)43(42(37)40,31-14-3-1-4-15-31)32-16-5-2-6-17-32;44-33-17-11-12-29(26-33)30-22-24-38-37-19-8-10-21-41(37)45(42(38)27-30)34-23-25-36-35-18-7-9-20-39(35)43(40(36)28-34,31-13-3-1-4-14-31)32-15-5-2-6-16-32;44-33-17-11-12-29(26-33)30-22-24-37-36-19-8-10-21-41(36)45(42(37)27-30)34-23-25-40-38(28-34)35-18-7-9-20-39(35)43(40,31-13-3-1-4-14-31)32-15-5-2-6-16-32/h4*1-28H
InChIKeyHYTNXTMHWVGZNP-UHFFFAOYSA-N
XLogP46.31
TPSA19.72 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms180
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002554.43
LogP ≤ 546.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole?
The IUPAC name of 2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole (CID 158627410) is 2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole.
What is the SMILES notation for 2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole?
The canonical SMILES for 2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole is Brc1cccc(-c2ccc3c4ccccc4n(-c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)c3c2)c1.Brc1cccc(-c2ccc3c4ccccc4n(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c3c2)c1.Brc1cccc(-c2ccc3c4ccccc4n(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)c3c2)c1.Brc1cccc(-c2ccc3c4ccccc4n(-c4cccc5c4C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c3c2)c1.
What is the InChIKey of 2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole?
The InChIKey is HYTNXTMHWVGZNP-UHFFFAOYSA-N. The full InChI is InChI=1S/4C43H28BrN/c44-33-18-11-13-29(27-33)30-25-26-35-34-19-8-10-23-39(34)45(41(35)28-30)40-24-12-22-38-42(40)36-20-7-9-21-37(36)43(38,31-14-3-1-4-15-31)32-16-5-2-6-17-32;44-33-18-11-13-29(27-33)30-25-26-36-35-20-8-10-23-39(35)45(41(36)28-30)40-24-12-21-37-34-19-7-9-22-38(34)43(42(37)40,31-14-3-1-4-15-31)32-16-5-2-6-17-32;44-33-17-11-12-29(26-33)30-22-24-38-37-19-8-10-21-41(37)45(42(38)27-30)34-23-25-36-35-18-7-9-20-39(35)43(40(36)28-34,31-13-3-1-4-14-31)32-15-5-2-6-16-32;44-33-17-11-12-29(26-33)30-22-24-37-36-19-8-10-21-41(36)45(42(37)27-30)34-23-25-40-38(28-34)35-18-7-9-20-39(35)43(40,31-13-3-1-4-14-31)32-15-5-2-6-16-32/h4*1-28H.
What are the key properties of 2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole?
2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole has a molecular weight of 2554.43 g/mol, XLogP of 46.31, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole is sourced from PubChem (CID 158627410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).