9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine

C165H111N9O2S — CID 161400773

IUPAC9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine
SMILESCC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc3n4-c3ccccc3)cc21.c1ccc(N2c3ccccc3Oc3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)Sc6ccccc6N7c6ccccc6)ccc4n5-c4ccccc4)ccc32)cc1.c1ccc(N2c3ccccc3Oc3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/C57H41N3.C54H35N3OS.C54H35N3O/c1-57(2)49-23-13-15-25-55(49)60(44-20-10-5-11-21-44)56-33-29-41(37-50(56)57)40-28-32-54-48(36-40)47-35-39(27-31-53(47)59(54)43-18-8-4-9-19-43)38-26-30-52-46(34-38)45-22-12-14-24-51(45)58(52)42-16-6-3-7-17-42;1-4-14-40(15-5-1)55-45-28-24-36(38-26-30-48-52(34-38)58-51-22-12-10-20-47(51)56(48)41-16-6-2-7-17-41)32-43(45)44-33-37(25-29-46(44)55)39-27-31-50-54(35-39)59-53-23-13-11-21-49(53)57(50)42-18-8-3-9-19-42;1-4-14-40(15-5-1)55-47-21-11-10-20-43(47)44-32-36(24-28-48(44)55)37-25-29-49-45(33-37)46-34-38(26-30-50(46)56(49)41-16-6-2-7-17-41)39-27-31-52-54(35-39)58-53-23-13-12-22-51(53)57(52)42-18-8-3-9-19-42/h3-37H,1-2H3;1-35H;1-35H
InChIKeyVUFAHMHIWHQBHH-UHFFFAOYSA-N
MW2283.83 g/mol
LogP45.74
Rot. Bonds15

About 9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine

9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine (PubChem CID 161400773) has the molecular formula C165H111N9O2S and a molecular weight of 2283.83 g/mol. Its IUPAC name is 9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine.

Molecular Properties

Compound Name9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine
PubChem CID161400773
Molecular FormulaC165H111N9O2S
Molecular Weight2283.83 g/mol
Exact Mass2281.86
IUPAC Name9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine
SMILESCC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc3n4-c3ccccc3)cc21.c1ccc(N2c3ccccc3Oc3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)Sc6ccccc6N7c6ccccc6)ccc4n5-c4ccccc4)ccc32)cc1.c1ccc(N2c3ccccc3Oc3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/C57H41N3.C54H35N3OS.C54H35N3O/c1-57(2)49-23-13-15-25-55(49)60(44-20-10-5-11-21-44)56-33-29-41(37-50(56)57)40-28-32-54-48(36-40)47-35-39(27-31-53(47)59(54)43-18-8-4-9-19-43)38-26-30-52-46(34-38)45-22-12-14-24-51(45)58(52)42-16-6-3-7-17-42;1-4-14-40(15-5-1)55-45-28-24-36(38-26-30-48-52(34-38)58-51-22-12-10-20-47(51)56(48)41-16-6-2-7-17-41)32-43(45)44-33-37(25-29-46(44)55)39-27-31-50-54(35-39)59-53-23-13-11-21-49(53)57(50)42-18-8-3-9-19-42;1-4-14-40(15-5-1)55-47-21-11-10-20-43(47)44-32-36(24-28-48(44)55)37-25-29-49-45(33-37)46-34-38(26-30-50(46)56(49)41-16-6-2-7-17-41)39-27-31-52-54(35-39)58-53-23-13-12-22-51(53)57(52)42-18-8-3-9-19-42/h3-37H,1-2H3;1-35H;1-35H
InChIKeyVUFAHMHIWHQBHH-UHFFFAOYSA-N
XLogP45.74
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds15
Heavy Atoms177
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002283.83
LogP ≤ 545.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

14,14-dimethyl-11-(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene
CID 67416472
3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-10-phenylphenothiazine
CID 134475698
9,9-dimethyl-10-(4-spiro[benzo[b][1,4]benzoxasiline-10,5'-benzo[b][1]benzosilole]-3'-ylphenyl)acridine;9-(4-spiro[benzo[b][1,4]benzoxasiline-10,5'-benzo[b][1]benzosilole]-3'-ylphenyl)carbazole;10-(4-spiro[benzo[b][1,4]benzoxasiline-10,5'-benzo[b][1]benzosilole]-3'-ylphenyl)phenothiazine;10-(4-spiro[benzo[b][1,4]benzoxasiline-10,5'-benzo[b][1]benzosilole]-3'-ylphenyl)phenoxazine
CID 157232639
10-phenyl-3-[4-[9-(3-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine
CID 134476436
3-(9-phenylcarbazol-3-yl)-10-(3-phenylphenyl)phenoxazine
CID 134475961
10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,9-dimethyl-2-(9-phenylcarbazol-3-yl)acridine
CID 118528312
N,N-diphenyl-4-[3-(10-phenylphenoxazin-3-yl)carbazol-9-yl]aniline
CID 147912487
2-[9-(4-dibenzothiophen-2-ylphenyl)carbazol-3-yl]-9,9-dimethyl-10-phenylacridine
CID 70936057
10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine
CID 134475798
10-(3-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]phenothiazine
CID 134476408
16-carbazol-9-yl-5,10,13,13-tetraphenyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14(19),15,17-nonaene;3-(13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-5-yl)-10-phenylphenoxazine;5-(9,9-dimethyl-7,10-diphenylacridin-2-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;5-(2,7-diphenylcarbazol-9-yl)-13,13-diphenyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene
CID 159668317
3,6-bis(4-carbazol-9-ylphenyl)-9-methylcarbazole;3-(4-carbazol-9-ylphenyl)-9-methylcarbazole;10-methyl-3,7-bis(9-phenylcarbazol-3-yl)phenothiazine;10-methyl-3,7-bis(10-phenylphenothiazin-3-yl)phenothiazine;3-[9-methyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]-10-phenylphenothiazine;10-methyl-3-(9-phenylcarbazol-3-yl)-7-(10-phenylphenothiazin-3-yl)phenothiazine
CID 159664393

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine?
The IUPAC name of 9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine (CID 161400773) is 9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine.
What is the SMILES notation for 9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine?
The canonical SMILES for 9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine is CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc3n4-c3ccccc3)cc21.c1ccc(N2c3ccccc3Oc3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)Sc6ccccc6N7c6ccccc6)ccc4n5-c4ccccc4)ccc32)cc1.c1ccc(N2c3ccccc3Oc3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc4n5-c4ccccc4)ccc32)cc1.
What is the InChIKey of 9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine?
The InChIKey is VUFAHMHIWHQBHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H41N3.C54H35N3OS.C54H35N3O/c1-57(2)49-23-13-15-25-55(49)60(44-20-10-5-11-21-44)56-33-29-41(37-50(56)57)40-28-32-54-48(36-40)47-35-39(27-31-53(47)59(54)43-18-8-4-9-19-43)38-26-30-52-46(34-38)45-22-12-14-24-51(45)58(52)42-16-6-3-7-17-42;1-4-14-40(15-5-1)55-45-28-24-36(38-26-30-48-52(34-38)58-51-22-12-10-20-47(51)56(48)41-16-6-2-7-17-41)32-43(45)44-33-37(25-29-46(44)55)39-27-31-50-54(35-39)59-53-23-13-11-21-49(53)57(50)42-18-8-3-9-19-42;1-4-14-40(15-5-1)55-47-21-11-10-20-43(47)44-32-36(24-28-48(44)55)37-25-29-49-45(33-37)46-34-38(26-30-50(46)56(49)41-16-6-2-7-17-41)39-27-31-52-54(35-39)58-53-23-13-12-22-51(53)57(52)42-18-8-3-9-19-42/h3-37H,1-2H3;1-35H;1-35H.
What are the key properties of 9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine?
9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine has a molecular weight of 2283.83 g/mol, XLogP of 45.74, 15 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine is sourced from PubChem (CID 161400773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).