5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole

C33H25N5 — CID 174276983

IUPAC5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole
SMILESc1ccc(C2N=C(n3c4ccccc4c4c5[nH]c6ccccc6c5ccc43)NC(c3ccccc3)N2)cc1
InChIInChI=1S/C33H25N5/c1-3-11-21(12-4-1)31-35-32(22-13-5-2-6-14-22)37-33(36-31)38-27-18-10-8-16-25(27)29-28(38)20-19-24-23-15-7-9-17-26(23)34-30(24)29/h1-20,31-32,34-35H,(H,36,37)
InChIKeyGDTAAJJDFDZPEJ-UHFFFAOYSA-N
MW491.60 g/mol
LogP7.22
Rot. Bonds2

About 5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole

5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole (PubChem CID 174276983) has the molecular formula C33H25N5 and a molecular weight of 491.60 g/mol. Its IUPAC name is 5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole.

Molecular Properties

Compound Name5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole
PubChem CID174276983
Molecular FormulaC33H25N5
Molecular Weight491.60 g/mol
Exact Mass491.21
IUPAC Name5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole
SMILESc1ccc(C2N=C(n3c4ccccc4c4c5[nH]c6ccccc6c5ccc43)NC(c3ccccc3)N2)cc1
InChIInChI=1S/C33H25N5/c1-3-11-21(12-4-1)31-35-32(22-13-5-2-6-14-22)37-33(36-31)38-27-18-10-8-16-25(27)29-28(38)20-19-24-23-15-7-9-17-26(23)34-30(24)29/h1-20,31-32,34-35H,(H,36,37)
InChIKeyGDTAAJJDFDZPEJ-UHFFFAOYSA-N
XLogP7.22
TPSA57.14 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500491.60
LogP ≤ 57.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole with MolForge

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Related Compounds

11-phenyl-12-[2-phenyl-4-[3-(4-phenylphenyl)phenyl]-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]indolo[2,3-a]carbazole
CID 174276849
9-[4-(3,20-dithiapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaen-6-yl)-2-(4-phenylphenyl)-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]carbazole
CID 163869835
1,1'-biphenyl;5-[3-(3-phenylphenyl)phenyl]-12H-indolo[3,2-c]carbazole
CID 142615329
11-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-5-(9-phenylcarbazol-3-yl)benzo[a]carbazole
CID 118398709
5-(2,3,4,5,6-pentadeuteriophenyl)-12H-indolo[3,2-c]carbazole
CID 142619140
5-[3-(2,6-diphenyl-1,2-dihydropyridin-4-yl)phenyl]-12H-indolo[3,2-c]carbazole
CID 71135374
9-[4-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 129156452
9-[4-(3,20-dithiapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaen-6-yl)-2-phenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl]-1-phenylcarbazole
CID 163513033
15-(2-phenylphenyl)-4,15,26-triazaheptacyclo[14.11.0.02,14.03,11.05,10.019,27.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19(27),20,22,24-dodecaene
CID 176965447
5-[3,5-bis(4-tert-butylphenyl)phenyl]-12H-indolo[3,2-c]carbazole
CID 175982941
9-[2-(4,6-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-2-yl)-5-phenylphenyl]-2-phenyl-5-(9-phenylcarbazol-4-yl)carbazole
CID 174269557
7-(2,4-diphenyl-1,2-dihydro-1,3,5-triazin-6-yl)-2-(7-phenylnaphthalen-2-yl)benzo[c]carbazole
CID 137214924

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole?
The IUPAC name of 5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole (CID 174276983) is 5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole.
What is the SMILES notation for 5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole?
The canonical SMILES for 5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole is c1ccc(C2N=C(n3c4ccccc4c4c5[nH]c6ccccc6c5ccc43)NC(c3ccccc3)N2)cc1.
What is the InChIKey of 5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole?
The InChIKey is GDTAAJJDFDZPEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H25N5/c1-3-11-21(12-4-1)31-35-32(22-13-5-2-6-14-22)37-33(36-31)38-27-18-10-8-16-25(27)29-28(38)20-19-24-23-15-7-9-17-26(23)34-30(24)29/h1-20,31-32,34-35H,(H,36,37).
What are the key properties of 5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole?
5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole has a molecular weight of 491.60 g/mol, XLogP of 7.22, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-6-yl)-12H-indolo[3,2-c]carbazole is sourced from PubChem (CID 174276983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).