2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole

C42H30N2 — CID 118189717

IUPAC2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole
SMILESC1=C[C@H](c2ccc3c4ccccc4n(-c4ccc(-c5ccccc5)cc4)c3c2)Cc2c1c1ccccc1n2-c1ccccc1
InChIInChI=1S/C42H30N2/c1-3-11-29(12-4-1)30-19-23-34(24-20-30)44-40-18-10-8-16-36(40)38-26-22-32(28-42(38)44)31-21-25-37-35-15-7-9-17-39(35)43(41(37)27-31)33-13-5-2-6-14-33/h1-26,28,31H,27H2/t31-/m0/s1
InChIKeyFAHHYCSFXKLAMY-HKBQPEDESA-N
MW562.72 g/mol
LogP10.75
Rot. Bonds4

About 2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole

2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole (PubChem CID 118189717) has the molecular formula C42H30N2 and a molecular weight of 562.72 g/mol. Its IUPAC name is 2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole.

Molecular Properties

Compound Name2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole
PubChem CID118189717
Molecular FormulaC42H30N2
Molecular Weight562.72 g/mol
Exact Mass562.24
IUPAC Name2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole
SMILESC1=C[C@H](c2ccc3c4ccccc4n(-c4ccc(-c5ccccc5)cc4)c3c2)Cc2c1c1ccccc1n2-c1ccccc1
InChIInChI=1S/C42H30N2/c1-3-11-29(12-4-1)30-19-23-34(24-20-30)44-40-18-10-8-16-36(40)38-26-22-32(28-42(38)44)31-21-25-37-35-15-7-9-17-39(35)43(41(37)27-31)33-13-5-2-6-14-33/h1-26,28,31H,27H2/t31-/m0/s1
InChIKeyFAHHYCSFXKLAMY-HKBQPEDESA-N
XLogP10.75
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500562.72
LogP ≤ 510.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(9-phenylcarbazol-2-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 142356248
2-carbazol-9-yl-9-[9-[4-(4-phenylphenyl)phenyl]carbazol-2-yl]carbazole
CID 170659707
5-phenyl-11-[4-(4-phenylphenyl)phenyl]indolo[3,2-b]carbazole
CID 142356573
3-[9-[4,6-bis(8-fluorodibenzothiophen-2-yl)pyrimidin-2-yl]-1,2-dihydrocarbazol-2-yl]-9-phenylcarbazole
CID 144597225
3-[9-(4-dibenzofuran-2-ylphenyl)-7-methyl-7,8-dihydrocarbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 159168669
9-phenyl-2-(9-phenyl-7,8-dihydrocarbazol-2-yl)carbazole
CID 144650170
6-(9-phenylcarbazol-3-yl)-2,9-bis(4-phenylphenyl)carbazole
CID 137400811
2-[9-(4-phenylphenyl)carbazol-2-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole
CID 155241336
6-(4-carbazol-9-ylphenyl)-2,9-diphenylcarbazole
CID 126682018
3,6-diphenyl-9-[4-(9-phenylcarbazol-2-yl)phenyl]carbazole
CID 118084405
2,7-diphenyl-9-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 166037407
3-(4-carbazol-9-ylphenyl)-5,11-diphenylindolo[3,2-b]carbazole
CID 134194444

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole?
The IUPAC name of 2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole (CID 118189717) is 2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole.
What is the SMILES notation for 2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole?
The canonical SMILES for 2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole is C1=C[C@H](c2ccc3c4ccccc4n(-c4ccc(-c5ccccc5)cc4)c3c2)Cc2c1c1ccccc1n2-c1ccccc1.
What is the InChIKey of 2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole?
The InChIKey is FAHHYCSFXKLAMY-HKBQPEDESA-N. The full InChI is InChI=1S/C42H30N2/c1-3-11-29(12-4-1)30-19-23-34(24-20-30)44-40-18-10-8-16-36(40)38-26-22-32(28-42(38)44)31-21-25-37-35-15-7-9-17-39(35)43(41(37)27-31)33-13-5-2-6-14-33/h1-26,28,31H,27H2/t31-/m0/s1.
What are the key properties of 2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole?
2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole has a molecular weight of 562.72 g/mol, XLogP of 10.75, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-9-phenyl-1,2-dihydrocarbazol-2-yl]-9-(4-phenylphenyl)carbazole is sourced from PubChem (CID 118189717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).