2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol

C34H26N4O2 — CID 164768767

IUPAC2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol
SMILESCC(C)Oc1nc(-c2ccc3c4c5ccccc5ccc4n(-c4ccccc4)c3c2)nc(-c2ccccc2O)n1
InChIInChI=1S/C34H26N4O2/c1-21(2)40-34-36-32(35-33(37-34)27-14-8-9-15-30(27)39)23-16-18-26-29(20-23)38(24-11-4-3-5-12-24)28-19-17-22-10-6-7-13-25(22)31(26)28/h3-21,39H,1-2H3
InChIKeyVUFGPJOBZGIQEQ-UHFFFAOYSA-N
MW522.61 g/mol
LogP7.95
Rot. Bonds5

About 2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol

2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol (PubChem CID 164768767) has the molecular formula C34H26N4O2 and a molecular weight of 522.61 g/mol. Its IUPAC name is 2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol.

Molecular Properties

Compound Name2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol
PubChem CID164768767
Molecular FormulaC34H26N4O2
Molecular Weight522.61 g/mol
Exact Mass522.21
IUPAC Name2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol
SMILESCC(C)Oc1nc(-c2ccc3c4c5ccccc5ccc4n(-c4ccccc4)c3c2)nc(-c2ccccc2O)n1
InChIInChI=1S/C34H26N4O2/c1-21(2)40-34-36-32(35-33(37-34)27-14-8-9-15-30(27)39)23-16-18-26-29(20-23)38(24-11-4-3-5-12-24)28-19-17-22-10-6-7-13-25(22)31(26)28/h3-21,39H,1-2H3
InChIKeyVUFGPJOBZGIQEQ-UHFFFAOYSA-N
XLogP7.95
TPSA73.06 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500522.61
LogP ≤ 57.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[4-(5-phenylbenzo[b]carbazol-2-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol
CID 164768547
2-[4-(9-phenylcarbazol-4-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol
CID 164768724
9-naphthalen-1-yl-7-[3-[4-phenyl-6-(6-phenylnaphthalen-2-yl)-1,3,5-triazin-2-yl]phenyl]benzo[c]carbazole
CID 167031844
10-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-phenylbenzo[c]carbazole
CID 118133204
3-[4-naphthalen-1-yl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 167378833
12-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 118449213
9-[3-(2-methylphenyl)phenyl]-7-phenylbenzo[c]carbazole
CID 90175676
7-(4-methylphenyl)-9-naphthalen-1-ylbenzo[c]carbazole
CID 139298795
7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(6-naphthalen-1-ylnaphthalen-2-yl)benzo[c]carbazole
CID 130351461
16-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)naphthalen-2-yl]-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 138654293
2-[4-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl)-6-propan-2-ylsulfanylpyrimidin-2-yl]phenol
CID 164768798
9-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-7-phenylbenzo[c]carbazole;10-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-7-phenylbenzo[c]carbazole;5-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-7-phenylbenzo[c]carbazole;9-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-7-phenylbenzo[c]carbazole;9-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-7-phenylbenzo[c]carbazole;10-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-7-phenylbenzo[c]carbazole;10-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-7-phenylbenzo[c]carbazole
CID 159515250

Frequently Asked Questions

What is the IUPAC name of 2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol?
The IUPAC name of 2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol (CID 164768767) is 2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol.
What is the SMILES notation for 2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol?
The canonical SMILES for 2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol is CC(C)Oc1nc(-c2ccc3c4c5ccccc5ccc4n(-c4ccccc4)c3c2)nc(-c2ccccc2O)n1.
What is the InChIKey of 2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol?
The InChIKey is VUFGPJOBZGIQEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H26N4O2/c1-21(2)40-34-36-32(35-33(37-34)27-14-8-9-15-30(27)39)23-16-18-26-29(20-23)38(24-11-4-3-5-12-24)28-19-17-22-10-6-7-13-25(22)31(26)28/h3-21,39H,1-2H3.
What are the key properties of 2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol?
2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol has a molecular weight of 522.61 g/mol, XLogP of 7.95, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(7-phenylbenzo[g]carbazol-9-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]phenol is sourced from PubChem (CID 164768767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).