2-benzhydryl-1,3-diphenylindole

C33H25N — CID 102040696

IUPAC2-benzhydryl-1,3-diphenylindole
SMILESc1ccc(-c2c(C(c3ccccc3)c3ccccc3)n(-c3ccccc3)c3ccccc23)cc1
InChIInChI=1S/C33H25N/c1-5-15-25(16-6-1)31(26-17-7-2-8-18-26)33-32(27-19-9-3-10-20-27)29-23-13-14-24-30(29)34(33)28-21-11-4-12-22-28/h1-24,31H
InChIKeyJABSGCMJKMZLRO-UHFFFAOYSA-N
MW435.57 g/mol
LogP8.48
Rot. Bonds5

About 2-benzhydryl-1,3-diphenylindole

2-benzhydryl-1,3-diphenylindole (PubChem CID 102040696) has the molecular formula C33H25N and a molecular weight of 435.57 g/mol. Its IUPAC name is 2-benzhydryl-1,3-diphenylindole.

Molecular Properties

Compound Name2-benzhydryl-1,3-diphenylindole
PubChem CID102040696
Molecular FormulaC33H25N
Molecular Weight435.57 g/mol
Exact Mass435.20
IUPAC Name2-benzhydryl-1,3-diphenylindole
SMILESc1ccc(-c2c(C(c3ccccc3)c3ccccc3)n(-c3ccccc3)c3ccccc23)cc1
InChIInChI=1S/C33H25N/c1-5-15-25(16-6-1)31(26-17-7-2-8-18-26)33-32(27-19-9-3-10-20-27)29-23-13-14-24-30(29)34(33)28-21-11-4-12-22-28/h1-24,31H
InChIKeyJABSGCMJKMZLRO-UHFFFAOYSA-N
XLogP8.48
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.57
LogP ≤ 58.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-[4-[phenyl-[4-(10-phenylanthracen-9-yl)phenyl]methyl]phenyl]carbazole
CID 129084995
3-[4-[bis(4-phenylphenyl)methyl]phenyl]-9-phenylcarbazole
CID 139542507
3-[1,2-bis[4-(4-phenylphenyl)phenyl]indol-3-yl]-1,2-diphenylindole
CID 129085579
9-(4-benzhydrylphenyl)-3-[9-[3-(3,5-diphenylphenyl)phenyl]carbazol-3-yl]-6-phenylcarbazole
CID 134168075
9-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]carbazole
CID 89408652
2-bromo-1,9-diphenylcarbazole
CID 174724226
2-benzhydryl-9-phenyl-6-[4-(4-phenylphenyl)phenyl]carbazole
CID 165167768
9-[4-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]carbazole;9-[4-[4-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[4-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]carbazole;9-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]carbazole
CID 159108089
9-[4-[10-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]anthracen-9-yl]phenyl]carbazole
CID 58971557
9-[3-(10-phenylanthracen-9-yl)phenyl]carbazole;9-[3-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]carbazole;9-[3-[10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]carbazole
CID 159418617
9-phenyl-3-[4-[10-[4-(9-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]carbazole;9-phenyl-3-[4-[4-[10-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]carbazole
CID 158416546
11-phenyl-12-(4-phenylphenyl)indolo[2,3-a]carbazole
CID 118501913

Frequently Asked Questions

What is the IUPAC name of 2-benzhydryl-1,3-diphenylindole?
The IUPAC name of 2-benzhydryl-1,3-diphenylindole (CID 102040696) is 2-benzhydryl-1,3-diphenylindole.
What is the SMILES notation for 2-benzhydryl-1,3-diphenylindole?
The canonical SMILES for 2-benzhydryl-1,3-diphenylindole is c1ccc(-c2c(C(c3ccccc3)c3ccccc3)n(-c3ccccc3)c3ccccc23)cc1.
What is the InChIKey of 2-benzhydryl-1,3-diphenylindole?
The InChIKey is JABSGCMJKMZLRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H25N/c1-5-15-25(16-6-1)31(26-17-7-2-8-18-26)33-32(27-19-9-3-10-20-27)29-23-13-14-24-30(29)34(33)28-21-11-4-12-22-28/h1-24,31H.
What are the key properties of 2-benzhydryl-1,3-diphenylindole?
2-benzhydryl-1,3-diphenylindole has a molecular weight of 435.57 g/mol, XLogP of 8.48, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzhydryl-1,3-diphenylindole is sourced from PubChem (CID 102040696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).