2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine

C114H68N6O4 — CID 170018347

IUPAC2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine
SMILESC1=Cc2oc3c(-c4ccc(-c5ccc(-c6nc(-c7ccc8c(ccc9oc%10ccccc%10c98)c7)nc(-c7ccc(-c8cccc9oc%10ccccc%10c89)c8ccccc78)n6)cc5)c5ccccc45)cccc3c2C(c2ccc(-c3nc(-c4ccc(C5C=Cc6ccccc6C5)cc4)nc(-c4ccc5c(ccc6oc7ccccc7c65)c4)n3)c3ccccc23)C1
InChIInChI=1S/C114H68N6O4/c1-2-19-70-62-71(47-40-65(70)18-1)66-38-43-68(44-39-66)109-115-111(74-48-52-77-72(63-74)50-60-102-104(77)93-26-9-12-33-97(93)122-102)119-113(117-109)92-59-57-86(82-23-6-8-25-84(82)92)89-30-17-37-101-107(89)96-32-15-31-90(108(96)124-101)87-55-54-76(79-20-3-4-21-80(79)87)67-41-45-69(46-42-67)110-116-112(75-49-53-78-73(64-75)51-61-103-105(78)94-27-10-13-34-98(94)123-103)120-114(118-110)91-58-56-85(81-22-5-7-24-83(81)91)88-29-16-36-100-106(88)95-28-11-14-35-99(95)121-100/h1-29,31-61,63-64,71,89H,30,62H2
InChIKeyPIUAGWYEVOOYSD-UHFFFAOYSA-N
MW1585.84 g/mol
LogP30.17
Rot. Bonds11

About 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine

2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine (PubChem CID 170018347) has the molecular formula C114H68N6O4 and a molecular weight of 1585.84 g/mol. Its IUPAC name is 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine.

Molecular Properties

Compound Name2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine
PubChem CID170018347
Molecular FormulaC114H68N6O4
Molecular Weight1585.84 g/mol
Exact Mass1584.53
IUPAC Name2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine
SMILESC1=Cc2oc3c(-c4ccc(-c5ccc(-c6nc(-c7ccc8c(ccc9oc%10ccccc%10c98)c7)nc(-c7ccc(-c8cccc9oc%10ccccc%10c89)c8ccccc78)n6)cc5)c5ccccc45)cccc3c2C(c2ccc(-c3nc(-c4ccc(C5C=Cc6ccccc6C5)cc4)nc(-c4ccc5c(ccc6oc7ccccc7c65)c4)n3)c3ccccc23)C1
InChIInChI=1S/C114H68N6O4/c1-2-19-70-62-71(47-40-65(70)18-1)66-38-43-68(44-39-66)109-115-111(74-48-52-77-72(63-74)50-60-102-104(77)93-26-9-12-33-97(93)122-102)119-113(117-109)92-59-57-86(82-23-6-8-25-84(82)92)89-30-17-37-101-107(89)96-32-15-31-90(108(96)124-101)87-55-54-76(79-20-3-4-21-80(79)87)67-41-45-69(46-42-67)110-116-112(75-49-53-78-73(64-75)51-61-103-105(78)94-27-10-13-34-98(94)123-103)120-114(118-110)91-58-56-85(81-22-5-7-24-83(81)91)88-29-16-36-100-106(88)95-28-11-14-35-99(95)121-100/h1-29,31-61,63-64,71,89H,30,62H2
InChIKeyPIUAGWYEVOOYSD-UHFFFAOYSA-N
XLogP30.17
TPSA129.90 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds11
Heavy Atoms124
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001585.84
LogP ≤ 530.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine with MolForge

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Related Compounds

2-[4-(7-dibenzofuran-1-yldibenzofuran-1-yl)naphthalen-1-yl]-4-(1,2-dihydronaphthalen-2-yl)-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine
CID 170013631
2-[3-(1,2-dihydronaphthalen-2-yl)-4-phenylphenyl]-4-naphthalen-2-yl-6-(7-phenyldibenzofuran-1-yl)-1,3,5-triazine
CID 170237130
2-[4-(7-dibenzofuran-1-yldibenzofuran-1-yl)naphthalen-1-yl]-4-naphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine
CID 166743109
2-[4-(7-butyl-1,2-dihydronaphthalen-2-yl)phenyl]-4-(6-butylnaphthalen-2-yl)-6-(6-phenyldibenzofuran-1-yl)-1,3,5-triazine
CID 170021120
2-(3-dibenzofuran-1-yldibenzofuran-1-yl)-4-(1,2-dihydronaphthalen-2-yl)-6-phenyl-1,3,5-triazine
CID 170009033
2-(1,2-dihydronaphthalen-2-yl)-4-(9-naphtho[1,2-b][1]benzofuran-6-yldibenzofuran-1-yl)-6-phenyl-1,3,5-triazine
CID 170009870
2-(1,2-dihydronaphthalen-2-yl)-4-(8-naphtho[1,2-b][1]benzofuran-7-yldibenzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 167007887
2-dibenzofuran-1-yl-4-naphthalen-2-yl-6-[4-(4-phenylcyclohexa-1,5-dien-1-yl)naphthalen-1-yl]-1,3,5-triazine
CID 177112927
2-(3-dibenzofuran-1-ylphenyl)-4-(1,2-dihydronaphthalen-2-yl)-6-(3-phenylphenyl)-1,3,5-triazine
CID 167008024
2-(1,2-dihydronaphthalen-2-yl)-4-(4-phenyldibenzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 170422642
2-(7-dibenzofuran-1-ylnaphthalen-2-yl)-4-(1,2-dihydrodibenzofuran-1-yl)-6-naphthalen-2-yl-1,3,5-triazine
CID 170123504
2-(3-dibenzofuran-1-ylphenyl)-4-[4-(1,2-dihydronaphthalen-1-yl)phenyl]-6-naphthalen-2-yl-1,3,5-triazine
CID 170222893

Frequently Asked Questions

What is the IUPAC name of 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine?
The IUPAC name of 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine (CID 170018347) is 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine.
What is the SMILES notation for 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine?
The canonical SMILES for 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine is C1=Cc2oc3c(-c4ccc(-c5ccc(-c6nc(-c7ccc8c(ccc9oc%10ccccc%10c98)c7)nc(-c7ccc(-c8cccc9oc%10ccccc%10c89)c8ccccc78)n6)cc5)c5ccccc45)cccc3c2C(c2ccc(-c3nc(-c4ccc(C5C=Cc6ccccc6C5)cc4)nc(-c4ccc5c(ccc6oc7ccccc7c65)c4)n3)c3ccccc23)C1.
What is the InChIKey of 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine?
The InChIKey is PIUAGWYEVOOYSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C114H68N6O4/c1-2-19-70-62-71(47-40-65(70)18-1)66-38-43-68(44-39-66)109-115-111(74-48-52-77-72(63-74)50-60-102-104(77)93-26-9-12-33-97(93)122-102)119-113(117-109)92-59-57-86(82-23-6-8-25-84(82)92)89-30-17-37-101-107(89)96-32-15-31-90(108(96)124-101)87-55-54-76(79-20-3-4-21-80(79)87)67-41-45-69(46-42-67)110-116-112(75-49-53-78-73(64-75)51-61-103-105(78)94-27-10-13-34-98(94)123-103)120-114(118-110)91-58-56-85(81-22-5-7-24-83(81)91)88-29-16-36-100-106(88)95-28-11-14-35-99(95)121-100/h1-29,31-61,63-64,71,89H,30,62H2.
What are the key properties of 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine?
2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine has a molecular weight of 1585.84 g/mol, XLogP of 30.17, 11 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4-[4-[4-[9-[4-[4-[4-(1,2-dihydronaphthalen-2-yl)phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazin-2-yl]naphthalen-1-yl]-8,9-dihydrodibenzofuran-4-yl]naphthalen-1-yl]phenyl]-6-naphtho[2,1-b][1]benzofuran-3-yl-1,3,5-triazine is sourced from PubChem (CID 170018347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).