N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine

C46H34N2 — CID 145362267

IUPACN,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine
SMILESC1=Cc2c(ccc3c2c2ccc(N(c4ccccc4)c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc2n3-c2ccccc2)CC1
InChIInChI=1S/C46H34N2/c1-4-12-33(13-5-1)34-20-22-35(23-21-34)36-24-27-40(28-25-36)47(38-15-6-2-7-16-38)41-29-30-43-45(32-41)48(39-17-8-3-9-18-39)44-31-26-37-14-10-11-19-42(37)46(43)44/h1-9,11-13,15-32H,10,14H2
InChIKeySHKITZNHDAROSZ-UHFFFAOYSA-N
MW614.79 g/mol
LogP12.55
Rot. Bonds6

About N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine

N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine (PubChem CID 145362267) has the molecular formula C46H34N2 and a molecular weight of 614.79 g/mol. Its IUPAC name is N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine.

Molecular Properties

Compound NameN,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine
PubChem CID145362267
Molecular FormulaC46H34N2
Molecular Weight614.79 g/mol
Exact Mass614.27
IUPAC NameN,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine
SMILESC1=Cc2c(ccc3c2c2ccc(N(c4ccccc4)c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc2n3-c2ccccc2)CC1
InChIInChI=1S/C46H34N2/c1-4-12-33(13-5-1)34-20-22-35(23-21-34)36-24-27-40(28-25-36)47(38-15-6-2-7-16-38)41-29-30-43-45(32-41)48(39-17-8-3-9-18-39)44-31-26-37-14-10-11-19-42(37)46(43)44/h1-9,11-13,15-32H,10,14H2
InChIKeySHKITZNHDAROSZ-UHFFFAOYSA-N
XLogP12.55
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500614.79
LogP ≤ 512.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole
CID 144920260
N-(6,7-dihydrodibenzofuran-3-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 131997661
3-[4-(10,11-dihydro-[1]benzothiolo[3,2-c]carbazol-5-yl)phenyl]-N,N-diphenylaniline
CID 163478286
3-N-(6,9-diphenylcarbazol-2-yl)-1-N,1-N-diphenyl-3-N-[3-(N-phenylanilino)phenyl]benzene-1,3-diamine
CID 177275802
N-[3-[3-(9-phenylcarbazol-4-yl)phenyl]phenyl]-N-[4-(4-phenylphenyl)phenyl]-1,2-dihydrophenanthren-9-amine
CID 166660616
9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)carbazol-2-amine
CID 118155144
9-phenyl-N,N-bis[4-(4-phenylphenyl)phenyl]carbazol-2-amine
CID 90351080
9-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine
CID 90351084
N-naphtho[1,2-b][1]benzothiol-7-yl-N,7-diphenyl-3,4-dihydrobenzo[c]carbazol-10-amine
CID 163812576
4-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)aniline;N,N,9-tris(4-phenylphenyl)carbazol-2-amine
CID 159022204
3-phenyl-4-(9-phenyl-7,8-dihydrocarbazol-3-yl)-N,N-bis(4-phenylphenyl)aniline
CID 134320780
N,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine
CID 169009789

Frequently Asked Questions

What is the IUPAC name of N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine?
The IUPAC name of N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine (CID 145362267) is N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine.
What is the SMILES notation for N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine?
The canonical SMILES for N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine is C1=Cc2c(ccc3c2c2ccc(N(c4ccccc4)c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc2n3-c2ccccc2)CC1.
What is the InChIKey of N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine?
The InChIKey is SHKITZNHDAROSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H34N2/c1-4-12-33(13-5-1)34-20-22-35(23-21-34)36-24-27-40(28-25-36)47(38-15-6-2-7-16-38)41-29-30-43-45(32-41)48(39-17-8-3-9-18-39)44-31-26-37-14-10-11-19-42(37)46(43)44/h1-9,11-13,15-32H,10,14H2.
What are the key properties of N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine?
N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine has a molecular weight of 614.79 g/mol, XLogP of 12.55, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine is sourced from PubChem (CID 145362267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).