2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole

C82H55ClN10 — CID 162051396

IUPAC2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole
SMILESClc1cccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5c6c(ccc54)ccn6-c4ccccc4)c3)n2)cc1.c1ccc(-n2ccc3ccc4[nH]c5ccccc5c4c32)cc1
InChIInChI=1S/C41H27N5.C21H14ClN3.C20H14N2/c1-4-13-29(14-5-1)39-42-40(30-15-6-2-7-16-30)44-41(43-39)31-17-12-20-33(27-31)46-35-22-11-10-21-34(35)37-36(46)24-23-28-25-26-45(38(28)37)32-18-8-3-9-19-32;22-18-13-7-12-17(14-18)21-24-19(15-8-3-1-4-9-15)23-20(25-21)16-10-5-2-6-11-16;1-2-6-15(7-3-1)22-13-12-14-10-11-18-19(20(14)22)16-8-4-5-9-17(16)21-18/h1-27H;1-14H;1-13,21H
InChIKeyYYPAWNACLGNSHY-UHFFFAOYSA-N
MW1215.87 g/mol
LogP20.70
Rot. Bonds9

About 2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole

2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole (PubChem CID 162051396) has the molecular formula C82H55ClN10 and a molecular weight of 1215.87 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole.

Molecular Properties

Compound Name2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole
PubChem CID162051396
Molecular FormulaC82H55ClN10
Molecular Weight1215.87 g/mol
Exact Mass1214.43
IUPAC Name2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole
SMILESClc1cccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5c6c(ccc54)ccn6-c4ccccc4)c3)n2)cc1.c1ccc(-n2ccc3ccc4[nH]c5ccccc5c4c32)cc1
InChIInChI=1S/C41H27N5.C21H14ClN3.C20H14N2/c1-4-13-29(14-5-1)39-42-40(30-15-6-2-7-16-30)44-41(43-39)31-17-12-20-33(27-31)46-35-22-11-10-21-34(35)37-36(46)24-23-28-25-26-45(38(28)37)32-18-8-3-9-19-32;22-18-13-7-12-17(14-18)21-24-19(15-8-3-1-4-9-15)23-20(25-21)16-10-5-2-6-11-16;1-2-6-15(7-3-1)22-13-12-14-10-11-18-19(20(14)22)16-8-4-5-9-17(16)21-18/h1-27H;1-14H;1-13,21H
InChIKeyYYPAWNACLGNSHY-UHFFFAOYSA-N
XLogP20.70
TPSA107.92 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds9
Heavy Atoms93
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001215.87
LogP ≤ 520.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-chlorophenyl)-4-phenylquinazoline;9-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-phenyl-14-[3-(4-phenylquinazolin-2-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 159353225
1-phenyl-6-[3-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[3,2-c]carbazole
CID 118317427
6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole
CID 90130563
5-[4-[3-[6-[3-[3-[4-(5H-indolo[3,2-c]carbazol-12-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-12-(3-phenylphenyl)indolo[3,2-c]carbazole
CID 156556355
4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-methylphenyl]-14-phenyl-4,14-diazapentacyclo[11.7.0.02,10.03,7.015,20]icosa-1(13),2(10),3(7),5,8,11,15,17,19-nonaene
CID 90223028
14-[3-(4,6-dipyridin-2-ylpyrimidin-2-yl)phenyl]-4-phenyl-4,14-diazapentacyclo[11.7.0.02,10.03,7.015,20]icosa-1(13),2(10),3(7),5,8,11,15,17,19-nonaene
CID 90222961
12-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-18-phenyl-12,18-diazahexacyclo[11.11.0.02,11.03,8.016,24.017,21]tetracosa-1(13),2(11),3,5,7,9,14,16(24),17(21),19,22-undecaene
CID 90223661
23-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,18-diphenyl-9,18,23-triazahexacyclo[11.10.0.02,10.03,8.014,22.017,21]tricosa-1(13),2(10),3,5,7,11,14(22),15,17(21),19-decaene
CID 90267290
2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;2,3-diphenyl-10H-pyrrolo[3,2-a]carbazole;10-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylpyrrolo[3,2-a]carbazole
CID 159800613
14-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-4-phenyl-4,14-diazapentacyclo[11.7.0.02,10.03,7.015,20]icosa-1(13),2(10),3(7),5,8,11,15,17,19-nonaene
CID 90222950
9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-14-[3-(4-phenylphenyl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 122598828
14-[4-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-4-phenyl-4,14-diazapentacyclo[11.7.0.02,10.03,7.015,20]icosa-1(13),2(10),3(7),5,8,11,15,17,19-nonaene
CID 90222949

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole?
The IUPAC name of 2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole (CID 162051396) is 2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole.
What is the SMILES notation for 2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole?
The canonical SMILES for 2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole is Clc1cccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5c6c(ccc54)ccn6-c4ccccc4)c3)n2)cc1.c1ccc(-n2ccc3ccc4[nH]c5ccccc5c4c32)cc1.
What is the InChIKey of 2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole?
The InChIKey is YYPAWNACLGNSHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H27N5.C21H14ClN3.C20H14N2/c1-4-13-29(14-5-1)39-42-40(30-15-6-2-7-16-30)44-41(43-39)31-17-12-20-33(27-31)46-35-22-11-10-21-34(35)37-36(46)24-23-28-25-26-45(38(28)37)32-18-8-3-9-19-32;22-18-13-7-12-17(14-18)21-24-19(15-8-3-1-4-9-15)23-20(25-21)16-10-5-2-6-11-16;1-2-6-15(7-3-1)22-13-12-14-10-11-18-19(20(14)22)16-8-4-5-9-17(16)21-18/h1-27H;1-14H;1-13,21H.
What are the key properties of 2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole?
2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole has a molecular weight of 1215.87 g/mol, XLogP of 20.70, 9 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-4,6-diphenyl-1,3,5-triazine;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylpyrrolo[3,2-c]carbazole;1-phenyl-6H-pyrrolo[3,2-c]carbazole is sourced from PubChem (CID 162051396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).