[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole

C317H240N22O6 — CID 157419840

IUPAC[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole
SMILESC.C.Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)cc3)cc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)cc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(Oc3ccc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)cc3)cc2)cc1.OCc1ccc(Oc2ccc(-c3ccc(-c4nc5ccccc5o4)cc3)cc2)cc1.c1ccc(-n2c(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc3ccccc32)cc1.c1ccc(-n2c(-c3ccc(-c4ccc(Oc5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4)cc3)nc3ccccc32)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)cc2)cc1.c1ccc(N(c2ccccc2)c2ccc(Oc3ccc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C45H35N3O.C45H35N3.C43H29N3O.C43H31N3O.C39H31N3.C37H25N3.C37H27N3.C26H19NO3.2CH4/c1-32-12-22-38(23-13-32)47(39-24-14-33(2)15-25-39)40-26-30-42(31-27-40)49-41-28-20-35(21-29-41)34-16-18-36(19-17-34)45-46-43-10-6-7-11-44(43)48(45)37-8-4-3-5-9-37;1-32-12-26-40(27-13-32)47(41-28-14-33(2)15-29-41)42-30-24-37(25-31-42)35-18-16-34(17-19-35)36-20-22-38(23-21-36)45-46-43-10-6-7-11-44(43)48(45)39-8-4-3-5-9-39;1-2-10-33(11-3-1)46-42-17-9-6-14-39(42)44-43(46)32-20-18-30(19-21-32)31-22-26-35(27-23-31)47-36-28-24-34(25-29-36)45-40-15-7-4-12-37(40)38-13-5-8-16-41(38)45;1-4-12-35(13-5-1)45(36-14-6-2-7-15-36)38-26-30-40(31-27-38)47-39-28-24-33(25-29-39)32-20-22-34(23-21-32)43-44-41-18-10-11-19-42(41)46(43)37-16-8-3-9-17-37;1-28-12-22-34(23-13-28)41(35-24-14-29(2)15-25-35)36-26-20-31(21-27-36)30-16-18-32(19-17-30)39-40-37-10-6-7-11-38(37)42(39)33-8-4-3-5-9-33;1-2-10-29(11-3-1)40-36-17-9-6-14-33(36)38-37(40)28-20-18-26(19-21-28)27-22-24-30(25-23-27)39-34-15-7-4-12-31(34)32-13-5-8-16-35(32)39;1-4-12-31(13-5-1)39(32-14-6-2-7-15-32)34-26-24-29(25-27-34)28-20-22-30(23-21-28)37-38-35-18-10-11-19-36(35)40(37)33-16-8-3-9-17-33;28-17-18-5-13-22(14-6-18)29-23-15-11-20(12-16-23)19-7-9-21(10-8-19)26-27-24-3-1-2-4-25(24)30-26;;/h3-31H,1-2H3;3-31H,1-2H3;1-29H;1-31H;3-27H,1-2H3;1-25H;1-27H;1-16,28H,17H2;2*1H4
InChIKeyBPGXJWXDNIWIEA-UHFFFAOYSA-N
MW4453.55 g/mol
LogP84.67
Rot. Bonds50

About [4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole

[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole (PubChem CID 157419840) has the molecular formula C317H240N22O6 and a molecular weight of 4453.55 g/mol. Its IUPAC name is [4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole.

Molecular Properties

Compound Name[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole
PubChem CID157419840
Molecular FormulaC317H240N22O6
Molecular Weight4453.55 g/mol
Exact Mass4449.92
IUPAC Name[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole
SMILESC.C.Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)cc3)cc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)cc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(Oc3ccc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)cc3)cc2)cc1.OCc1ccc(Oc2ccc(-c3ccc(-c4nc5ccccc5o4)cc3)cc2)cc1.c1ccc(-n2c(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc3ccccc32)cc1.c1ccc(-n2c(-c3ccc(-c4ccc(Oc5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4)cc3)nc3ccccc32)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)cc2)cc1.c1ccc(N(c2ccccc2)c2ccc(Oc3ccc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C45H35N3O.C45H35N3.C43H29N3O.C43H31N3O.C39H31N3.C37H25N3.C37H27N3.C26H19NO3.2CH4/c1-32-12-22-38(23-13-32)47(39-24-14-33(2)15-25-39)40-26-30-42(31-27-40)49-41-28-20-35(21-29-41)34-16-18-36(19-17-34)45-46-43-10-6-7-11-44(43)48(45)37-8-4-3-5-9-37;1-32-12-26-40(27-13-32)47(41-28-14-33(2)15-29-41)42-30-24-37(25-31-42)35-18-16-34(17-19-35)36-20-22-38(23-21-36)45-46-43-10-6-7-11-44(43)48(45)39-8-4-3-5-9-39;1-2-10-33(11-3-1)46-42-17-9-6-14-39(42)44-43(46)32-20-18-30(19-21-32)31-22-26-35(27-23-31)47-36-28-24-34(25-29-36)45-40-15-7-4-12-37(40)38-13-5-8-16-41(38)45;1-4-12-35(13-5-1)45(36-14-6-2-7-15-36)38-26-30-40(31-27-38)47-39-28-24-33(25-29-39)32-20-22-34(23-21-32)43-44-41-18-10-11-19-42(41)46(43)37-16-8-3-9-17-37;1-28-12-22-34(23-13-28)41(35-24-14-29(2)15-25-35)36-26-20-31(21-27-36)30-16-18-32(19-17-30)39-40-37-10-6-7-11-38(37)42(39)33-8-4-3-5-9-33;1-2-10-29(11-3-1)40-36-17-9-6-14-33(36)38-37(40)28-20-18-26(19-21-28)27-22-24-30(25-23-27)39-34-15-7-4-12-31(34)32-13-5-8-16-35(32)39;1-4-12-31(13-5-1)39(32-14-6-2-7-15-32)34-26-24-29(25-27-34)28-20-22-30(23-21-28)37-38-35-18-10-11-19-36(35)40(37)33-16-8-3-9-17-33;28-17-18-5-13-22(14-6-18)29-23-15-11-20(12-16-23)19-7-9-21(10-8-19)26-27-24-3-1-2-4-25(24)30-26;;/h3-31H,1-2H3;3-31H,1-2H3;1-29H;1-31H;3-27H,1-2H3;1-25H;1-27H;1-16,28H,17H2;2*1H4
InChIKeyBPGXJWXDNIWIEA-UHFFFAOYSA-N
XLogP84.67
TPSA233.98 Ų
H-Bond Donors1
H-Bond Acceptors28
Rotatable Bonds50
Heavy Atoms345
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004453.55
LogP ≤ 584.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1028

Analyze [4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole with MolForge

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Related Compounds

N-[4-(1,3-benzoxazol-2-yl)phenyl]-N-phenyl-9-(4-phenylphenyl)carbazol-3-amine
CID 59500988
9-[4-(1,3-benzoxazol-2-yl)phenyl]-N-[9-[4-(1,3-benzoxazol-2-yl)phenyl]carbazol-3-yl]-N-phenylcarbazol-3-amine
CID 126585578
[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol
CID 58057288
4-(1,3-benzoxazol-2-yl)-N-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-N-phenylaniline
CID 59500916
2-[3-(1,3-benzoxazol-2-yl)-5-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;3-[2-[2-[3,5-bis(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]-9-phenylcarbazole;9-phenyl-3-[2-[2-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]carbazole;N-phenyl-N-[4-[2-[2-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine
CID 162176172
N-[4-(1,3-benzoxazol-2-yl)phenyl]-9-(4-naphthalen-1-ylphenyl)-N-phenylcarbazol-3-amine;N-[4-(1,3-benzoxazol-2-yl)phenyl]-9-(4-naphthalen-2-ylphenyl)-N-phenylcarbazol-3-amine;N-[4-(1,3-benzoxazol-2-yl)phenyl]-N-phenyl-9-(3-phenylphenyl)carbazol-3-amine;N-[4-(1,3-benzoxazol-2-yl)phenyl]-N-phenyl-9-(4-phenylphenyl)carbazol-3-amine
CID 160958614
N,9-diphenyl-N-[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazol-3-amine
CID 59500875
9-(4-naphthalen-2-ylphenyl)-N-phenyl-N-[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazol-3-amine
CID 59500896
2-[3-[6-[3-(1,3-benzoxazol-2-yl)phenyl]-9-(4-methylphenyl)carbazol-3-yl]phenyl]-1,3-benzoxazole;2-[4-[6-[4-(1,3-benzoxazol-2-yl)phenyl]-9-(4-methylphenyl)carbazol-3-yl]phenyl]-1,3-benzoxazole;9-(4-methylphenyl)-3,6-bis[2-(1-phenylbenzimidazol-2-yl)phenyl]carbazole
CID 162206431
1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol
CID 157369314
9-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 58470934
2-[6-(1,3-benzoxazol-2-yl)-9-[4-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-yl]-1,3-benzoxazole
CID 155366571

Frequently Asked Questions

What is the IUPAC name of [4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole?
The IUPAC name of [4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole (CID 157419840) is [4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole.
What is the SMILES notation for [4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole?
The canonical SMILES for [4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole is C.C.Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)cc3)cc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)cc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(Oc3ccc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)cc3)cc2)cc1.OCc1ccc(Oc2ccc(-c3ccc(-c4nc5ccccc5o4)cc3)cc2)cc1.c1ccc(-n2c(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc3ccccc32)cc1.c1ccc(-n2c(-c3ccc(-c4ccc(Oc5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4)cc3)nc3ccccc32)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)cc2)cc1.c1ccc(N(c2ccccc2)c2ccc(Oc3ccc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)cc3)cc2)cc1.
What is the InChIKey of [4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole?
The InChIKey is BPGXJWXDNIWIEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H35N3O.C45H35N3.C43H29N3O.C43H31N3O.C39H31N3.C37H25N3.C37H27N3.C26H19NO3.2CH4/c1-32-12-22-38(23-13-32)47(39-24-14-33(2)15-25-39)40-26-30-42(31-27-40)49-41-28-20-35(21-29-41)34-16-18-36(19-17-34)45-46-43-10-6-7-11-44(43)48(45)37-8-4-3-5-9-37;1-32-12-26-40(27-13-32)47(41-28-14-33(2)15-29-41)42-30-24-37(25-31-42)35-18-16-34(17-19-35)36-20-22-38(23-21-36)45-46-43-10-6-7-11-44(43)48(45)39-8-4-3-5-9-39;1-2-10-33(11-3-1)46-42-17-9-6-14-39(42)44-43(46)32-20-18-30(19-21-32)31-22-26-35(27-23-31)47-36-28-24-34(25-29-36)45-40-15-7-4-12-37(40)38-13-5-8-16-41(38)45;1-4-12-35(13-5-1)45(36-14-6-2-7-15-36)38-26-30-40(31-27-38)47-39-28-24-33(25-29-39)32-20-22-34(23-21-32)43-44-41-18-10-11-19-42(41)46(43)37-16-8-3-9-17-37;1-28-12-22-34(23-13-28)41(35-24-14-29(2)15-25-35)36-26-20-31(21-27-36)30-16-18-32(19-17-30)39-40-37-10-6-7-11-38(37)42(39)33-8-4-3-5-9-33;1-2-10-29(11-3-1)40-36-17-9-6-14-33(36)38-37(40)28-20-18-26(19-21-28)27-22-24-30(25-23-27)39-34-15-7-4-12-31(34)32-13-5-8-16-35(32)39;1-4-12-31(13-5-1)39(32-14-6-2-7-15-32)34-26-24-29(25-27-34)28-20-22-30(23-21-28)37-38-35-18-10-11-19-36(35)40(37)33-16-8-3-9-17-33;28-17-18-5-13-22(14-6-18)29-23-15-11-20(12-16-23)19-7-9-21(10-8-19)26-27-24-3-1-2-4-25(24)30-26;;/h3-31H,1-2H3;3-31H,1-2H3;1-29H;1-31H;3-27H,1-2H3;1-25H;1-27H;1-16,28H,17H2;2*1H4.
What are the key properties of [4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole?
[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole has a molecular weight of 4453.55 g/mol, XLogP of 84.67, 50 rotatable bonds, 1 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]phenoxy]phenyl]methanol;N,N-diphenyl-4-[4-(1-phenylbenzimidazol-2-yl)phenyl]aniline;N,N-diphenyl-4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]aniline;methane;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-methyl-N-(4-methylphenyl)-N-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]aniline;9-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenoxy]phenyl]carbazole;9-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]carbazole is sourced from PubChem (CID 157419840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).