7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole

C39H27N — CID 123149938

IUPAC7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole
SMILESCc1ccc(-c2ccc(-n3c4ccc(-c5cccc6ccccc56)cc4c4c5ccccc5ccc43)cc2)cc1
InChIInChI=1S/C39H27N/c1-26-13-15-27(16-14-26)28-17-21-32(22-18-28)40-37-23-20-31(34-12-6-9-29-7-2-4-10-33(29)34)25-36(37)39-35-11-5-3-8-30(35)19-24-38(39)40/h2-25H,1H3
InChIKeyWGGSFMQSHRJAOC-UHFFFAOYSA-N
MW509.65 g/mol
LogP10.73
Rot. Bonds3

About 7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole

7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole (PubChem CID 123149938) has the molecular formula C39H27N and a molecular weight of 509.65 g/mol. Its IUPAC name is 7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole.

Molecular Properties

Compound Name7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole
PubChem CID123149938
Molecular FormulaC39H27N
Molecular Weight509.65 g/mol
Exact Mass509.21
IUPAC Name7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole
SMILESCc1ccc(-c2ccc(-n3c4ccc(-c5cccc6ccccc56)cc4c4c5ccccc5ccc43)cc2)cc1
InChIInChI=1S/C39H27N/c1-26-13-15-27(16-14-26)28-17-21-32(22-18-28)40-37-23-20-31(34-12-6-9-29-7-2-4-10-33(29)34)25-36(37)39-35-11-5-3-8-30(35)19-24-38(39)40/h2-25H,1H3
InChIKeyWGGSFMQSHRJAOC-UHFFFAOYSA-N
XLogP10.73
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500509.65
LogP ≤ 510.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

7-(4-methylphenyl)-9-naphthalen-1-ylbenzo[c]carbazole
CID 139298795
9-[4-(6-naphthalen-1-ylnaphthalen-2-yl)phenyl]-3-(4-naphthalen-1-ylphenyl)carbazole
CID 177074752
16-(4-naphthalen-1-ylphenyl)-12-(9-phenylcarbazol-2-yl)-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 164761193
12-phenyl-7-(9-phenylcarbazol-3-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaene
CID 121246518
9-(4-naphthalen-1-ylphenyl)-5-phenyl-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 139312614
16-(3-naphthalen-1-ylphenyl)-12-phenyl-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 174232921
2-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole
CID 130351342
2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole
CID 130295051
5-(4-fluoranthen-2-ylphenyl)-2-(7-phenylbenzo[c]carbazol-10-yl)benzo[b]carbazole
CID 130295046
10-methyl-7-phenylbenzo[c]carbazole
CID 66635542
9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole
CID 177074708
9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)carbazole
CID 177074694

Frequently Asked Questions

What is the IUPAC name of 7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole?
The IUPAC name of 7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole (CID 123149938) is 7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole.
What is the SMILES notation for 7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole?
The canonical SMILES for 7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole is Cc1ccc(-c2ccc(-n3c4ccc(-c5cccc6ccccc56)cc4c4c5ccccc5ccc43)cc2)cc1.
What is the InChIKey of 7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole?
The InChIKey is WGGSFMQSHRJAOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H27N/c1-26-13-15-27(16-14-26)28-17-21-32(22-18-28)40-37-23-20-31(34-12-6-9-29-7-2-4-10-33(29)34)25-36(37)39-35-11-5-3-8-30(35)19-24-38(39)40/h2-25H,1H3.
What are the key properties of 7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole?
7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole has a molecular weight of 509.65 g/mol, XLogP of 10.73, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-(4-methylphenyl)phenyl]-10-naphthalen-1-ylbenzo[c]carbazole is sourced from PubChem (CID 123149938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).