N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine

C152H98N16O4 — CID 164956877

IUPACN-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc4ccc5nn(-c6ccccc6)nc5c4c3)cc2)cc1.c1ccc(-c2ccccc2N(c2ccc3c(c2)oc2ccccc23)c2ccc3ccc4nn(-c5ccccc5)nc4c3c2)cc1.c1ccc(N(c2ccc3c(c2)oc2ccccc23)c2ccc3ccc4ccc5nn(-c6ccccc6)nc5c4c3c2)cc1.c1ccc(N(c2ccc3ccc4nn(-c5ccccc5)nc4c3c2)c2cccc3oc4ccccc4c23)cc1
InChIInChI=1S/2C40H26N4O.C38H24N4O.C34H22N4O/c1-3-11-27(12-4-1)32-15-7-9-17-37(32)43(31-22-23-34-33-16-8-10-18-38(33)45-39(34)26-31)30-21-19-28-20-24-36-40(35(28)25-30)42-44(41-36)29-13-5-2-6-14-29;1-3-9-27(10-4-1)28-15-19-30(20-16-28)43(33-22-23-35-34-13-7-8-14-38(34)45-39(35)26-33)32-21-17-29-18-24-37-40(36(29)25-32)42-44(41-37)31-11-5-2-6-12-31;1-3-9-27(10-4-1)41(30-20-21-32-31-13-7-8-14-35(31)43-36(32)24-30)29-19-17-25-15-16-26-18-22-34-38(37(26)33(25)23-29)40-42(39-34)28-11-5-2-6-12-28;1-3-10-24(11-4-1)37(30-15-9-17-32-33(30)27-14-7-8-16-31(27)39-32)26-20-18-23-19-21-29-34(28(23)22-26)36-38(35-29)25-12-5-2-6-13-25/h2*1-26H;1-24H;1-22H
InChIKeyBHGFZHOCWDNBHH-UHFFFAOYSA-N
MW2212.56 g/mol
LogP40.26
Rot. Bonds18

About N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine

N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine (PubChem CID 164956877) has the molecular formula C152H98N16O4 and a molecular weight of 2212.56 g/mol. Its IUPAC name is N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine.

Molecular Properties

Compound NameN-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine
PubChem CID164956877
Molecular FormulaC152H98N16O4
Molecular Weight2212.56 g/mol
Exact Mass2210.80
IUPAC NameN-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc4ccc5nn(-c6ccccc6)nc5c4c3)cc2)cc1.c1ccc(-c2ccccc2N(c2ccc3c(c2)oc2ccccc23)c2ccc3ccc4nn(-c5ccccc5)nc4c3c2)cc1.c1ccc(N(c2ccc3c(c2)oc2ccccc23)c2ccc3ccc4ccc5nn(-c6ccccc6)nc5c4c3c2)cc1.c1ccc(N(c2ccc3ccc4nn(-c5ccccc5)nc4c3c2)c2cccc3oc4ccccc4c23)cc1
InChIInChI=1S/2C40H26N4O.C38H24N4O.C34H22N4O/c1-3-11-27(12-4-1)32-15-7-9-17-37(32)43(31-22-23-34-33-16-8-10-18-38(33)45-39(34)26-31)30-21-19-28-20-24-36-40(35(28)25-30)42-44(41-36)29-13-5-2-6-14-29;1-3-9-27(10-4-1)28-15-19-30(20-16-28)43(33-22-23-35-34-13-7-8-14-38(34)45-39(35)26-33)32-21-17-29-18-24-37-40(36(29)25-32)42-44(41-37)31-11-5-2-6-12-31;1-3-9-27(10-4-1)41(30-20-21-32-31-13-7-8-14-35(31)43-36(32)24-30)29-19-17-25-15-16-26-18-22-34-38(37(26)33(25)23-29)40-42(39-34)28-11-5-2-6-12-28;1-3-10-24(11-4-1)37(30-15-9-17-32-33(30)27-14-7-8-16-31(27)39-32)26-20-18-23-19-21-29-34(28(23)22-26)36-38(35-29)25-12-5-2-6-13-25/h2*1-26H;1-24H;1-22H
InChIKeyBHGFZHOCWDNBHH-UHFFFAOYSA-N
XLogP40.26
TPSA188.36 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds18
Heavy Atoms172
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002212.56
LogP ≤ 540.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine with MolForge

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Related Compounds

N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)naphtho[1,2-e]benzotriazol-10-amine
CID 164740322
N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine
CID 164740360
N-phenyl-N-[4-(2-phenylnaphtho[1,2-e]benzotriazol-9-yl)phenyl]dibenzofuran-2-amine
CID 170254580
N-naphthalen-2-yl-N-[4-(2-phenylnaphtho[1,2-e]benzotriazol-9-yl)naphthalen-1-yl]dibenzofuran-3-amine
CID 170254578
N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-[4-(2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-yl)phenyl]dibenzofuran-1-amine;N-phenyl-N-[4-(2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-yl)phenyl]dibenzofuran-4-amine
CID 163893650
N-dibenzothiophen-3-yl-2-phenyl-N-[2-(2-phenylphenyl)phenyl]naphtho[1,2-e]benzotriazol-10-amine
CID 170254249
2-phenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-e]benzotriazol-9-amine
CID 170254413
N-(4-dibenzofuran-1-ylphenyl)-2-phenyl-N-(2-phenylphenyl)naphtho[1,2-e][1,3]benzoxazol-10-amine
CID 177119483
N-dibenzofuran-1-yl-2-phenyl-N-[4-(2-phenylphenyl)phenyl]-[1]benzofuro[2,3-g][1,3]benzoxazol-8-amine
CID 167124589
N-[4-(9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaen-6-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-3-amine
CID 174322022
methane;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine
CID 165018255
N-[2-[2-(N-dibenzofuran-3-yl-4-phenylanilino)phenyl]phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 167086852

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine?
The IUPAC name of N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine (CID 164956877) is N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine.
What is the SMILES notation for N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine?
The canonical SMILES for N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine is c1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc4ccc5nn(-c6ccccc6)nc5c4c3)cc2)cc1.c1ccc(-c2ccccc2N(c2ccc3c(c2)oc2ccccc23)c2ccc3ccc4nn(-c5ccccc5)nc4c3c2)cc1.c1ccc(N(c2ccc3c(c2)oc2ccccc23)c2ccc3ccc4ccc5nn(-c6ccccc6)nc5c4c3c2)cc1.c1ccc(N(c2ccc3ccc4nn(-c5ccccc5)nc4c3c2)c2cccc3oc4ccccc4c23)cc1.
What is the InChIKey of N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine?
The InChIKey is BHGFZHOCWDNBHH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C40H26N4O.C38H24N4O.C34H22N4O/c1-3-11-27(12-4-1)32-15-7-9-17-37(32)43(31-22-23-34-33-16-8-10-18-38(33)45-39(34)26-31)30-21-19-28-20-24-36-40(35(28)25-30)42-44(41-36)29-13-5-2-6-14-29;1-3-9-27(10-4-1)28-15-19-30(20-16-28)43(33-22-23-35-34-13-7-8-14-38(34)45-39(35)26-33)32-21-17-29-18-24-37-40(36(29)25-32)42-44(41-37)31-11-5-2-6-12-31;1-3-9-27(10-4-1)41(30-20-21-32-31-13-7-8-14-35(31)43-36(32)24-30)29-19-17-25-15-16-26-18-22-34-38(37(26)33(25)23-29)40-42(39-34)28-11-5-2-6-12-28;1-3-10-24(11-4-1)37(30-15-9-17-32-33(30)27-14-7-8-16-31(27)39-32)26-20-18-23-19-21-29-34(28(23)22-26)36-38(35-29)25-12-5-2-6-13-25/h2*1-26H;1-24H;1-22H.
What are the key properties of N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine?
N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine has a molecular weight of 2212.56 g/mol, XLogP of 40.26, 18 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-1-yl-N,2-diphenylbenzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-N,2-diphenylnaphtho[1,2-e]benzotriazol-10-amine;N-dibenzofuran-3-yl-2-phenyl-N-(2-phenylphenyl)benzo[e]benzotriazol-8-amine;N-dibenzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)benzo[e]benzotriazol-8-amine is sourced from PubChem (CID 164956877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).