5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole

C94H57N15 — CID 161060080

IUPAC5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole
SMILESc1ccc(-c2ccc(-c3nnc(-n4c5ccccc5c5cc6ccccc6cc54)c4nccnc34)cc2)cc1.c1ccc(-c2nnc(-n3c4ccccc4c4cc5ccccc5cc43)c3nccnc23)cc1.c1ccc2cc(-c3nnc(-n4c5ccccc5c5cc6ccccc6cc54)c4nccnc34)ccc2c1
InChIInChI=1S/C34H21N5.C32H19N5.C28H17N5/c1-2-8-22(9-3-1)23-14-16-24(17-15-23)31-32-33(36-19-18-35-32)34(38-37-31)39-29-13-7-6-12-27(29)28-20-25-10-4-5-11-26(25)21-30(28)39;1-2-8-21-17-24(14-13-20(21)7-1)29-30-31(34-16-15-33-30)32(36-35-29)37-27-12-6-5-11-25(27)26-18-22-9-3-4-10-23(22)19-28(26)37;1-2-8-18(9-3-1)25-26-27(30-15-14-29-26)28(32-31-25)33-23-13-7-6-12-21(23)22-16-19-10-4-5-11-20(19)17-24(22)33/h1-21H;1-19H;1-17H
InChIKeyUDGXSNAFNSVUMN-UHFFFAOYSA-N
MW1396.60 g/mol
LogP21.83
Rot. Bonds7

About 5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole

5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole (PubChem CID 161060080) has the molecular formula C94H57N15 and a molecular weight of 1396.60 g/mol. Its IUPAC name is 5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole.

Molecular Properties

Compound Name5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole
PubChem CID161060080
Molecular FormulaC94H57N15
Molecular Weight1396.60 g/mol
Exact Mass1395.49
IUPAC Name5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole
SMILESc1ccc(-c2ccc(-c3nnc(-n4c5ccccc5c5cc6ccccc6cc54)c4nccnc34)cc2)cc1.c1ccc(-c2nnc(-n3c4ccccc4c4cc5ccccc5cc43)c3nccnc23)cc1.c1ccc2cc(-c3nnc(-n4c5ccccc5c5cc6ccccc6cc54)c4nccnc34)ccc2c1
InChIInChI=1S/C34H21N5.C32H19N5.C28H17N5/c1-2-8-22(9-3-1)23-14-16-24(17-15-23)31-32-33(36-19-18-35-32)34(38-37-31)39-29-13-7-6-12-27(29)28-20-25-10-4-5-11-26(25)21-30(28)39;1-2-8-21-17-24(14-13-20(21)7-1)29-30-31(34-16-15-33-30)32(36-35-29)37-27-12-6-5-11-25(27)26-18-22-9-3-4-10-23(22)19-28(26)37;1-2-8-18(9-3-1)25-26-27(30-15-14-29-26)28(32-31-25)33-23-13-7-6-12-21(23)22-16-19-10-4-5-11-20(19)17-24(22)33/h1-21H;1-19H;1-17H
InChIKeyUDGXSNAFNSVUMN-UHFFFAOYSA-N
XLogP21.83
TPSA169.47 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds7
Heavy Atoms109
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001396.60
LogP ≤ 521.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole with MolForge

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Related Compounds

5-(4-triphenylen-2-ylphthalazin-1-yl)benzo[b]carbazole
CID 139362303
5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole
CID 139361603
5-(4,7-dinaphthalen-2-yl-6-phenylquinazolin-2-yl)benzo[b]carbazole;5-(7-naphthalen-2-yl-4,6-diphenylquinazolin-2-yl)benzo[b]carbazole;5-(4-naphthalen-1-yl-7-naphthalen-2-yl-6-phenylquinazolin-2-yl)benzo[b]carbazole
CID 161085780
5-[4-(9-phenylcarbazol-2-yl)pteridin-2-yl]benzo[b]carbazole
CID 139361350
5-[3-(4-quinolin-8-ylphenyl)quinoxalin-2-yl]benzo[b]carbazole
CID 139361992
5-[6,7-diphenyl-4-(4-phenylphenyl)quinazolin-2-yl]benzo[b]carbazole
CID 139361845
5-chloro-8-dibenzofuran-3-ylpyrazino[2,3-d]pyridazine;12-(8-dibenzofuran-3-ylpyrazino[2,3-d]pyridazin-5-yl)-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;pentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene
CID 162030600
5-(3-phenanthren-2-ylquinoxalin-2-yl)-2-phenylbenzo[b]carbazole
CID 146539824
3-benzo[b]carbazol-5-yl-2,7-diphenyl-[1]benzothiolo[2,3-b]pyrazine
CID 137433490
2-benzo[b]carbazol-5-yl-5-[4-(3-naphthalen-2-ylquinoxalin-2-yl)phenyl]benzo[b]carbazole
CID 146375026
12-[8-(9-phenylcarbazol-2-yl)quinoxalin-5-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene
CID 139362045
2-(3-naphthalen-2-ylcarbazol-9-yl)-4-phenylbenzo[h]quinazoline
CID 122497106

Frequently Asked Questions

What is the IUPAC name of 5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole?
The IUPAC name of 5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole (CID 161060080) is 5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole.
What is the SMILES notation for 5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole?
The canonical SMILES for 5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole is c1ccc(-c2ccc(-c3nnc(-n4c5ccccc5c5cc6ccccc6cc54)c4nccnc34)cc2)cc1.c1ccc(-c2nnc(-n3c4ccccc4c4cc5ccccc5cc43)c3nccnc23)cc1.c1ccc2cc(-c3nnc(-n4c5ccccc5c5cc6ccccc6cc54)c4nccnc34)ccc2c1.
What is the InChIKey of 5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole?
The InChIKey is UDGXSNAFNSVUMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H21N5.C32H19N5.C28H17N5/c1-2-8-22(9-3-1)23-14-16-24(17-15-23)31-32-33(36-19-18-35-32)34(38-37-31)39-29-13-7-6-12-27(29)28-20-25-10-4-5-11-26(25)21-30(28)39;1-2-8-21-17-24(14-13-20(21)7-1)29-30-31(34-16-15-33-30)32(36-35-29)37-27-12-6-5-11-25(27)26-18-22-9-3-4-10-23(22)19-28(26)37;1-2-8-18(9-3-1)25-26-27(30-15-14-29-26)28(32-31-25)33-23-13-7-6-12-21(23)22-16-19-10-4-5-11-20(19)17-24(22)33/h1-21H;1-19H;1-17H.
What are the key properties of 5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole?
5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole has a molecular weight of 1396.60 g/mol, XLogP of 21.83, 7 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole is sourced from PubChem (CID 161060080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).