copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine

C165H95Cu5N12O4S5-15 — CID 159116455

About copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine

copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine (PubChem CID 159116455) has the molecular formula C165H95Cu5N12O4S5-15 and a molecular weight of 2787.72 g/mol. Its IUPAC name is copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine.

Molecular Properties

• Compound Name: copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine
• PubChem CID: 159116455
• Molecular Formula: C165H95Cu5N12O4S5-15
• Molecular Weight: 2787.72 g/mol
• Exact Mass: 2782.28
• IUPAC Name: copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine
• SMILES: Cn1c(-c2cccc3oc(N(c4[c-]c(-c5csc6cccnc56)ccc4)c4ccccc4)[c-]c23)[c-]c2ccccc21.Cn1cnc(-c2csc3cc4c5ccccc5n(-c5[c-]c(-c6csc7sc[c-]c67)ccc5)c4[c-]c23)c1.[Cu].[Cu].[Cu].[Cu].[Cu].[c-]1ccccc1-c1[c-]c(-n2c3[c-]c4c(-c5ccccn5)cccc4cc3c3ccccc32)ccc1.[c-]1ccccc1-c1[c-]c(N2c3[c-]c4c(-c5ccccn5)cccc4cc3Oc3ccccc32)ccc1.[c-]1ccccc1-c1coc2oc(N(c3[c-]c4c(cc3)CCc3ccc5scnc5c3-4)c3ccccc3)[c-]c12
• InChI: InChI=1S/C36H22N3OS.C33H19N2O2S.C33H19N2O.C33H19N2.C30H16N3S3.5Cu/c1-38-31-16-6-5-10-25(31)21-32(38)28-15-8-17-33-29(28)22-35(40-33)39(26-12-3-2-4-13-26)27-14-7-11-24(20-27)30-23-41-34-18-9-19-37-36(30)34;1-3-7-21(8-4-1)28-19-36-33-27(28)18-30(37-33)35(24-9-5-2-6-10-24)25-15-13-22-11-12-23-14-16-29-32(34-20-38-29)31(23)26(22)17-25;1-2-10-23(11-3-1)24-12-8-14-26(20-24)35-30-17-4-5-18-32(30)36-33-21-25-13-9-15-27(28(25)22-31(33)35)29-16-6-7-19-34-29;1-2-10-23(11-3-1)24-12-8-14-26(20-24)35-32-18-5-4-15-28(32)30-21-25-13-9-16-27(29(25)22-33(30)35)31-17-6-7-19-34-31;1-32-14-26(31-17-32)25-16-35-29-13-22-20-7-2-3-8-27(20)33(28(22)12-23(25)29)19-6-4-5-18(11-19)24-15-36-30-21(24)9-10-34-30;;;;;/h2-19,23H,1H3;1-7,9-10,13-16,19-20H,11-12H2;1-10,12-19,21H;1-10,12-19,21H;2-8,10,13-17H,1H3;;;;;/q5*-3
• InChIKey: IOFKUEODDHYVDY-UHFFFAOYSA-N
• XLogP: 44.02
• TPSA: 142.54 Ų
• H-Bond Acceptors: 21
• Rotatable Bonds: 18
• Heavy Atoms: 191
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2787.72
LogP ≤ 5	44.02
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine?

The IUPAC name of copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine (CID 159116455) is copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine.

What is the SMILES notation for copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine?

The canonical SMILES for copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine is Cn1c(-c2cccc3oc(N(c4[c-]c(-c5csc6cccnc56)ccc4)c4ccccc4)[c-]c23)[c-]c2ccccc21.Cn1cnc(-c2csc3cc4c5ccccc5n(-c5[c-]c(-c6csc7sc[c-]c67)ccc5)c4[c-]c23)c1.[Cu].[Cu].[Cu].[Cu].[Cu].[c-]1ccccc1-c1[c-]c(-n2c3[c-]c4c(-c5ccccn5)cccc4cc3c3ccccc32)ccc1.[c-]1ccccc1-c1[c-]c(N2c3[c-]c4c(-c5ccccn5)cccc4cc3Oc3ccccc32)ccc1.[c-]1ccccc1-c1coc2oc(N(c3[c-]c4c(cc3)CCc3ccc5scnc5c3-4)c3ccccc3)[c-]c12.

What is the InChIKey of copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine?

The InChIKey is IOFKUEODDHYVDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H22N3OS.C33H19N2O2S.C33H19N2O.C33H19N2.C30H16N3S3.5Cu/c1-38-31-16-6-5-10-25(31)21-32(38)28-15-8-17-33-29(28)22-35(40-33)39(26-12-3-2-4-13-26)27-14-7-11-24(20-27)30-23-41-34-18-9-19-37-36(30)34;1-3-7-21(8-4-1)28-19-36-33-27(28)18-30(37-33)35(24-9-5-2-6-10-24)25-15-13-22-11-12-23-14-16-29-32(34-20-38-29)31(23)26(22)17-25;1-2-10-23(11-3-1)24-12-8-14-26(20-24)35-30-17-4-5-18-32(30)36-33-21-25-13-9-15-27(28(25)22-31(33)35)29-16-6-7-19-34-29;1-2-10-23(11-3-1)24-12-8-14-26(20-24)35-32-18-5-4-15-28(32)30-21-25-13-9-16-27(29(25)22-33(30)35)31-17-6-7-19-34-31;1-32-14-26(31-17-32)25-16-35-29-13-22-20-7-2-3-8-27(20)33(28(22)12-23(25)29)19-6-4-5-18(11-19)24-15-36-30-21(24)9-10-34-30;;;;;/h2-19,23H,1H3;1-7,9-10,13-16,19-20H,11-12H2;1-10,12-19,21H;1-10,12-19,21H;2-8,10,13-17H,1H3;;;;;/q5*-3;;;;;.

What are the key properties of copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine?

copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine has a molecular weight of 2787.72 g/mol, XLogP of 44.02, 18 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for copper;1-(1-methylimidazol-4-yl)-9-[3-(3H-thieno[2,3-b]thiophen-3-id-4-yl)benzene-2-id-1-yl]-10H-thieno[3,2-b]carbazol-10-ide;4-(1-methyl-3H-indol-3-id-2-yl)-N-phenyl-N-(3-thieno[3,2-b]pyridin-3-ylbenzene-2-id-1-yl)-3H-1-benzofuran-3-id-2-amine;5-(3-phenylbenzene-2-id-1-yl)-7-pyridin-2-yl-6H-benzo[b]carbazol-6-ide;12-(3-phenylbenzene-2-id-1-yl)-10-pyridin-2-yl-11H-benzo[b]phenoxazin-11-ide;N-phenyl-N-(3-phenyl-4H-furo[2,3-b]furan-4-id-5-yl)-7,11-dihydro-6H-naphtho[1,2-e][1,3]benzothiazol-11-id-10-amine is sourced from PubChem (CID 159116455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).