[2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine

C263H199N15O9S2 — CID 158667352

IUPAC[2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine
SMILESCC1(C)c2ccccc2N(c2ccc(S(=O)(=O)c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)cc2)c2ccccc21.Cc1ccc(C(=O)c2cc(-c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)c(C(=O)c3ccc(C)cc3)cc2-c2ccc(N3c4ccccc4C(C)(C)c4ccccc43)cc2)cc1.Cc1ccc(C(=O)c2cc(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)c(C(=O)c3ccc(C)cc3)cc2-c2ccc(N3c4ccccc4Cc4ccccc43)cc2)cc1.O=S(=O)(c1ccc(N2c3ccccc3N(c3ccccc3)c3ccccc32)cc1)c1ccc(N2c3ccccc3N(c3ccccc3)c3ccccc32)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)c2cc(N(c4ccccc4)c4ccccc4)ccc2n3-c2ccc(-c3cnc4ccccc4n3)cc2)cc1
InChIInChI=1S/C64H52N2O2.C59H42N2O3.C50H35N5.C48H34N4O2S.C42H36N2O2S/c1-41-23-27-45(28-24-41)61(67)51-39-50(44-33-37-48(38-34-44)66-59-21-13-9-17-55(59)64(5,6)56-18-10-14-22-60(56)66)52(62(68)46-29-25-42(2)26-30-46)40-49(51)43-31-35-47(36-32-43)65-57-19-11-7-15-53(57)63(3,4)54-16-8-12-20-58(54)65;1-38-19-23-42(24-20-38)58(62)50-37-49(41-29-33-47(34-30-41)61-54-15-7-9-17-56(54)64-57-18-10-8-16-55(57)61)51(59(63)43-25-21-39(2)22-26-43)36-48(50)40-27-31-46(32-28-40)60-52-13-5-3-11-44(52)35-45-12-4-6-14-53(45)60;1-5-15-37(16-6-1)53(38-17-7-2-8-18-38)42-29-31-49-44(33-42)45-34-43(54(39-19-9-3-10-20-39)40-21-11-4-12-22-40)30-32-50(45)55(49)41-27-25-36(26-28-41)48-35-51-46-23-13-14-24-47(46)52-48;53-55(54,39-31-27-37(28-32-39)51-45-23-11-7-19-41(45)49(35-15-3-1-4-16-35)42-20-8-12-24-46(42)51)40-33-29-38(30-34-40)52-47-25-13-9-21-43(47)50(36-17-5-2-6-18-36)44-22-10-14-26-48(44)52;1-41(2)33-13-5-9-17-37(33)43(38-18-10-6-14-34(38)41)29-21-25-31(26-22-29)47(45,46)32-27-23-30(24-28-32)44-39-19-11-7-15-35(39)42(3,4)36-16-8-12-20-40(36)44/h7-40H,1-6H3;3-34,36-37H,35H2,1-2H3;1-35H;1-34H;5-28H,1-4H3
InChIKeyIDNJFEHCZHJUOL-UHFFFAOYSA-N
MW3777.71 g/mol
LogP68.46
Rot. Bonds34

About [2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine

[2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine (PubChem CID 158667352) has the molecular formula C263H199N15O9S2 and a molecular weight of 3777.71 g/mol. Its IUPAC name is [2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine.

Molecular Properties

Compound Name[2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine
PubChem CID158667352
Molecular FormulaC263H199N15O9S2
Molecular Weight3777.71 g/mol
Exact Mass3774.50
IUPAC Name[2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine
SMILESCC1(C)c2ccccc2N(c2ccc(S(=O)(=O)c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)cc2)c2ccccc21.Cc1ccc(C(=O)c2cc(-c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)c(C(=O)c3ccc(C)cc3)cc2-c2ccc(N3c4ccccc4C(C)(C)c4ccccc43)cc2)cc1.Cc1ccc(C(=O)c2cc(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)c(C(=O)c3ccc(C)cc3)cc2-c2ccc(N3c4ccccc4Cc4ccccc43)cc2)cc1.O=S(=O)(c1ccc(N2c3ccccc3N(c3ccccc3)c3ccccc32)cc1)c1ccc(N2c3ccccc3N(c3ccccc3)c3ccccc32)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)c2cc(N(c4ccccc4)c4ccccc4)ccc2n3-c2ccc(-c3cnc4ccccc4n3)cc2)cc1
InChIInChI=1S/C64H52N2O2.C59H42N2O3.C50H35N5.C48H34N4O2S.C42H36N2O2S/c1-41-23-27-45(28-24-41)61(67)51-39-50(44-33-37-48(38-34-44)66-59-21-13-9-17-55(59)64(5,6)56-18-10-14-22-60(56)66)52(62(68)46-29-25-42(2)26-30-46)40-49(51)43-31-35-47(36-32-43)65-57-19-11-7-15-53(57)63(3,4)54-16-8-12-20-58(54)65;1-38-19-23-42(24-20-38)58(62)50-37-49(41-29-33-47(34-30-41)61-54-15-7-9-17-56(54)64-57-18-10-8-16-55(57)61)51(59(63)43-25-21-39(2)22-26-43)36-48(50)40-27-31-46(32-28-40)60-52-13-5-3-11-44(52)35-45-12-4-6-14-53(45)60;1-5-15-37(16-6-1)53(38-17-7-2-8-18-38)42-29-31-49-44(33-42)45-34-43(54(39-19-9-3-10-20-39)40-21-11-4-12-22-40)30-32-50(45)55(49)41-27-25-36(26-28-41)48-35-51-46-23-13-14-24-47(46)52-48;53-55(54,39-31-27-37(28-32-39)51-45-23-11-7-19-41(45)49(35-15-3-1-4-16-35)42-20-8-12-24-46(42)51)40-33-29-38(30-34-40)52-47-25-13-9-21-43(47)50(36-17-5-2-6-18-36)44-22-10-14-26-48(44)52;1-41(2)33-13-5-9-17-37(33)43(38-18-10-6-14-34(38)41)29-21-25-31(26-22-29)47(45,46)32-27-23-30(24-28-32)44-39-19-11-7-15-35(39)42(3,4)36-16-8-12-20-40(36)44/h7-40H,1-6H3;3-34,36-37H,35H2,1-2H3;1-35H;1-34H;5-28H,1-4H3
InChIKeyIDNJFEHCZHJUOL-UHFFFAOYSA-N
XLogP68.46
TPSA215.38 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds34
Heavy Atoms289
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003777.71
LogP ≤ 568.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze [2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of [2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine?
The IUPAC name of [2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine (CID 158667352) is [2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine.
What is the SMILES notation for [2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine?
The canonical SMILES for [2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine is CC1(C)c2ccccc2N(c2ccc(S(=O)(=O)c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)cc2)c2ccccc21.Cc1ccc(C(=O)c2cc(-c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)c(C(=O)c3ccc(C)cc3)cc2-c2ccc(N3c4ccccc4C(C)(C)c4ccccc43)cc2)cc1.Cc1ccc(C(=O)c2cc(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)c(C(=O)c3ccc(C)cc3)cc2-c2ccc(N3c4ccccc4Cc4ccccc43)cc2)cc1.O=S(=O)(c1ccc(N2c3ccccc3N(c3ccccc3)c3ccccc32)cc1)c1ccc(N2c3ccccc3N(c3ccccc3)c3ccccc32)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)c2cc(N(c4ccccc4)c4ccccc4)ccc2n3-c2ccc(-c3cnc4ccccc4n3)cc2)cc1.
What is the InChIKey of [2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine?
The InChIKey is IDNJFEHCZHJUOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H52N2O2.C59H42N2O3.C50H35N5.C48H34N4O2S.C42H36N2O2S/c1-41-23-27-45(28-24-41)61(67)51-39-50(44-33-37-48(38-34-44)66-59-21-13-9-17-55(59)64(5,6)56-18-10-14-22-60(56)66)52(62(68)46-29-25-42(2)26-30-46)40-49(51)43-31-35-47(36-32-43)65-57-19-11-7-15-53(57)63(3,4)54-16-8-12-20-58(54)65;1-38-19-23-42(24-20-38)58(62)50-37-49(41-29-33-47(34-30-41)61-54-15-7-9-17-56(54)64-57-18-10-8-16-55(57)61)51(59(63)43-25-21-39(2)22-26-43)36-48(50)40-27-31-46(32-28-40)60-52-13-5-3-11-44(52)35-45-12-4-6-14-53(45)60;1-5-15-37(16-6-1)53(38-17-7-2-8-18-38)42-29-31-49-44(33-42)45-34-43(54(39-19-9-3-10-20-39)40-21-11-4-12-22-40)30-32-50(45)55(49)41-27-25-36(26-28-41)48-35-51-46-23-13-14-24-47(46)52-48;53-55(54,39-31-27-37(28-32-39)51-45-23-11-7-19-41(45)49(35-15-3-1-4-16-35)42-20-8-12-24-46(42)51)40-33-29-38(30-34-40)52-47-25-13-9-21-43(47)50(36-17-5-2-6-18-36)44-22-10-14-26-48(44)52;1-41(2)33-13-5-9-17-37(33)43(38-18-10-6-14-34(38)41)29-21-25-31(26-22-29)47(45,46)32-27-23-30(24-28-32)44-39-19-11-7-15-35(39)42(3,4)36-16-8-12-20-40(36)44/h7-40H,1-6H3;3-34,36-37H,35H2,1-2H3;1-35H;1-34H;5-28H,1-4H3.
What are the key properties of [2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine?
[2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine has a molecular weight of 3777.71 g/mol, XLogP of 68.46, 34 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[4-(9H-acridin-10-yl)phenyl]-4-(4-methylbenzoyl)-5-(4-phenoxazin-10-ylphenyl)phenyl]-(4-methylphenyl)methanone;[2,5-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone;10-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]sulfonylphenyl]-9,9-dimethylacridine;5-phenyl-10-[4-[4-(10-phenylphenazin-5-yl)phenyl]sulfonylphenyl]phenazine;3-N,3-N,6-N,6-N-tetraphenyl-9-(4-quinoxalin-2-ylphenyl)carbazole-3,6-diamine is sourced from PubChem (CID 158667352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).