5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole

C144H90N18 — CID 162150281

IUPAC5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole
SMILESCC1(C)c2ccccc2-c2cc(-c3nc(-n4c5ccccc5c5cc6ccccc6cc54)nc4cccnc34)ccc21.c1ccc(-n2c3ccccc3c3cc(-c4nc(-n5c6ccccc6c6cc7ccccc7cc65)nc5cccnc45)ccc32)cc1.c1ccc2cc(-c3nc(-n4c5ccccc5c5cc6ccccc6cc54)nc4nccnc34)ccc2c1.c1ccc2cc3c(cc2c1)c1ccccc1n3-c1nc(-c2cccc3ccccc23)c2cccnc2n1
InChIInChI=1S/C41H25N5.C38H26N4.C33H20N4.C32H19N5/c1-2-13-29(14-3-1)45-35-18-8-6-15-30(35)32-24-28(20-21-37(32)45)39-40-34(17-10-22-42-40)43-41(44-39)46-36-19-9-7-16-31(36)33-23-26-11-4-5-12-27(26)25-38(33)46;1-38(2)30-14-7-5-12-26(30)28-21-25(17-18-31(28)38)35-36-32(15-9-19-39-36)40-37(41-35)42-33-16-8-6-13-27(33)29-20-23-10-3-4-11-24(23)22-34(29)42;1-2-11-23-20-30-28(19-22(23)10-1)25-14-5-6-17-29(25)37(30)33-35-31(27-16-8-18-34-32(27)36-33)26-15-7-12-21-9-3-4-13-24(21)26;1-2-8-21-17-24(14-13-20(21)7-1)29-30-31(34-16-15-33-30)36-32(35-29)37-27-12-6-5-11-25(27)26-18-22-9-3-4-10-23(22)19-28(26)37/h1-25H;3-22H,1-2H3;1-20H;1-19H
InChIKeyZLCOUIWBMYQCQP-UHFFFAOYSA-N
MW2072.43 g/mol
LogP34.87
Rot. Bonds9

About 5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole

5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole (PubChem CID 162150281) has the molecular formula C144H90N18 and a molecular weight of 2072.43 g/mol. Its IUPAC name is 5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole.

Molecular Properties

Compound Name5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole
PubChem CID162150281
Molecular FormulaC144H90N18
Molecular Weight2072.43 g/mol
Exact Mass2070.76
IUPAC Name5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole
SMILESCC1(C)c2ccccc2-c2cc(-c3nc(-n4c5ccccc5c5cc6ccccc6cc54)nc4cccnc34)ccc21.c1ccc(-n2c3ccccc3c3cc(-c4nc(-n5c6ccccc6c6cc7ccccc7cc65)nc5cccnc45)ccc32)cc1.c1ccc2cc(-c3nc(-n4c5ccccc5c5cc6ccccc6cc54)nc4nccnc34)ccc2c1.c1ccc2cc3c(cc2c1)c1ccccc1n3-c1nc(-c2cccc3ccccc23)c2cccnc2n1
InChIInChI=1S/C41H25N5.C38H26N4.C33H20N4.C32H19N5/c1-2-13-29(14-3-1)45-35-18-8-6-15-30(35)32-24-28(20-21-37(32)45)39-40-34(17-10-22-42-40)43-41(44-39)46-36-19-9-7-16-31(36)33-23-26-11-4-5-12-27(26)25-38(33)46;1-38(2)30-14-7-5-12-26(30)28-21-25(17-18-31(28)38)35-36-32(15-9-19-39-36)40-37(41-35)42-33-16-8-6-13-27(33)29-20-23-10-3-4-11-24(23)22-34(29)42;1-2-11-23-20-30-28(19-22(23)10-1)25-14-5-6-17-29(25)37(30)33-35-31(27-16-8-18-34-32(27)36-33)26-15-7-12-21-9-3-4-13-24(21)26;1-2-8-21-17-24(14-13-20(21)7-1)29-30-31(34-16-15-33-30)36-32(35-29)37-27-12-6-5-11-25(27)26-18-22-9-3-4-10-23(22)19-28(26)37/h1-25H;3-22H,1-2H3;1-20H;1-19H
InChIKeyZLCOUIWBMYQCQP-UHFFFAOYSA-N
XLogP34.87
TPSA192.22 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds9
Heavy Atoms162
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002072.43
LogP ≤ 534.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole with MolForge

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Related Compounds

12-(9,9-dimethylfluoren-2-yl)-16-(4-phenylquinazolin-2-yl)-12,16-diazahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(13),2,4,6,8,10,14,17,19,21,23-undecaene;16-(4-naphthalen-1-ylquinazolin-2-yl)-12-phenyl-12,16-diazahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(13),2,4,6,8,10,14,17,19,21,23-undecaene;16-(4-naphthalen-2-ylquinazolin-2-yl)-12-phenyl-12,16-diazahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(13),2,4,6,8,10,14,17,19,21,23-undecaene
CID 158538438
12-[4-(9,9-dimethylfluoren-2-yl)pteridin-2-yl]-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaene
CID 139361742
5-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-3-yl)benzo[b]carbazole
CID 146874125
5-[4-(9-phenylcarbazol-2-yl)pteridin-2-yl]benzo[b]carbazole
CID 139361350
5-[4-(11,11-dimethylbenzo[b]fluoren-6-yl)quinazolin-2-yl]benzo[b]carbazole
CID 139361885
7,7-dimethyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-5-(4-phenylquinazolin-2-yl)indeno[2,1-b]carbazole
CID 118517262
5-(6-benzo[h]quinolin-10-yl-9-phenylcarbazol-3-yl)-7,7-dimethylindeno[2,1-b]carbazole
CID 118003381
5-(4-naphthalen-1-ylquinazolin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]benzo[b]carbazole
CID 142474116
5-[5,5-dimethyl-4-(9-phenylcarbazol-2-yl)indeno[1,2-d]pyrimidin-2-yl]benzo[b]carbazole
CID 137433938
10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole
CID 163797018
3-(9,9-dimethylfluoren-3-yl)-9-[4-(4-phenylphenyl)quinazolin-2-yl]carbazole
CID 142356903
7,7-dimethyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]benzo[e]perimidine
CID 147523957

Frequently Asked Questions

What is the IUPAC name of 5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole?
The IUPAC name of 5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole (CID 162150281) is 5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole.
What is the SMILES notation for 5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole?
The canonical SMILES for 5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole is CC1(C)c2ccccc2-c2cc(-c3nc(-n4c5ccccc5c5cc6ccccc6cc54)nc4cccnc34)ccc21.c1ccc(-n2c3ccccc3c3cc(-c4nc(-n5c6ccccc6c6cc7ccccc7cc65)nc5cccnc45)ccc32)cc1.c1ccc2cc(-c3nc(-n4c5ccccc5c5cc6ccccc6cc54)nc4nccnc34)ccc2c1.c1ccc2cc3c(cc2c1)c1ccccc1n3-c1nc(-c2cccc3ccccc23)c2cccnc2n1.
What is the InChIKey of 5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole?
The InChIKey is ZLCOUIWBMYQCQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H25N5.C38H26N4.C33H20N4.C32H19N5/c1-2-13-29(14-3-1)45-35-18-8-6-15-30(35)32-24-28(20-21-37(32)45)39-40-34(17-10-22-42-40)43-41(44-39)46-36-19-9-7-16-31(36)33-23-26-11-4-5-12-27(26)25-38(33)46;1-38(2)30-14-7-5-12-26(30)28-21-25(17-18-31(28)38)35-36-32(15-9-19-39-36)40-37(41-35)42-33-16-8-6-13-27(33)29-20-23-10-3-4-11-24(23)22-34(29)42;1-2-11-23-20-30-28(19-22(23)10-1)25-14-5-6-17-29(25)37(30)33-35-31(27-16-8-18-34-32(27)36-33)26-15-7-12-21-9-3-4-13-24(21)26;1-2-8-21-17-24(14-13-20(21)7-1)29-30-31(34-16-15-33-30)36-32(35-29)37-27-12-6-5-11-25(27)26-18-22-9-3-4-10-23(22)19-28(26)37/h1-25H;3-22H,1-2H3;1-20H;1-19H.
What are the key properties of 5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole?
5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole has a molecular weight of 2072.43 g/mol, XLogP of 34.87, 9 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(9,9-dimethylfluoren-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole;5-(4-naphthalen-2-ylpteridin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-ylpyrido[2,3-d]pyrimidin-2-yl)benzo[b]carbazole;5-[4-(9-phenylcarbazol-3-yl)pyrido[3,2-d]pyrimidin-2-yl]benzo[b]carbazole is sourced from PubChem (CID 162150281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).