7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one

C168H135N7O12 — CID 160752011

About 7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one

7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one (PubChem CID 160752011) has the molecular formula C168H135N7O12 and a molecular weight of 2443.96 g/mol. Its IUPAC name is 7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one.

Molecular Properties

• Compound Name: 7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one
• PubChem CID: 160752011
• Molecular Formula: C168H135N7O12
• Molecular Weight: 2443.96 g/mol
• Exact Mass: 2442.02
• IUPAC Name: 7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one
• SMILES: CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2ccc(-c4ccc5c(c4)c4cc(-c6cccc(-c7cc8cc9c%10c(c8oc7=O)C(C)(C)CCN%10CCC9(C)C)c6)ccc4n5-c4ccccc4)cc2)c(=O)oc31.CCN(CC)c1ccc2cc(-c3ccc(-c4ccc5c(c4)c4cc(-c6cccc(-c7cc8ccc(N(CC)CC)cc8oc7=O)c6)ccc4n5-c4ccccc4)cc3)c(=O)oc2c1.O=c1oc2ccc3ccccc3c2cc1-c1ccc2c(c1)c1cc(-c3cc4c(ccc5ccccc54)oc3=O)ccc1n2-c1ccccc1
• InChI: InChI=1S/C68H63N3O4.C56H47N3O4.C44H25NO4/c1-65(2)25-29-69-31-27-67(5,6)57-59(69)53(65)38-46-36-49(63(72)74-61(46)57)41-19-17-40(18-20-41)43-21-23-55-51(34-43)52-35-44(22-24-56(52)71(55)48-15-10-9-11-16-48)42-13-12-14-45(33-42)50-37-47-39-54-60-58(62(47)75-64(50)73)68(7,8)28-32-70(60)30-26-66(54,3)4;1-5-57(6-2)45-25-21-42-32-47(55(60)62-53(42)34-45)37-19-17-36(18-20-37)39-23-27-51-49(30-39)50-31-40(24-28-52(50)59(51)44-15-10-9-11-16-44)38-13-12-14-41(29-38)48-33-43-22-26-46(58(7-3)8-4)35-54(43)63-56(48)61;46-43-33(24-37-31-12-6-4-8-26(31)16-20-41(37)48-43)28-14-18-39-35(22-28)36-23-29(15-19-40(36)45(39)30-10-2-1-3-11-30)34-25-38-32-13-7-5-9-27(32)17-21-42(38)49-44(34)47/h9-24,33-39H,25-32H2,1-8H3;9-35H,5-8H2,1-4H3;1-25H
• InChIKey: RWYJIMFNACRYCZ-UHFFFAOYSA-N
• XLogP: 40.00
• TPSA: 209.01 Ų
• H-Bond Acceptors: 19
• Rotatable Bonds: 19
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2443.96
LogP ≤ 5	40.00
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'cumarine', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one?

The IUPAC name of 7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one (CID 160752011) is 7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one.

What is the SMILES notation for 7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one?

The canonical SMILES for 7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one is CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2ccc(-c4ccc5c(c4)c4cc(-c6cccc(-c7cc8cc9c%10c(c8oc7=O)C(C)(C)CCN%10CCC9(C)C)c6)ccc4n5-c4ccccc4)cc2)c(=O)oc31.CCN(CC)c1ccc2cc(-c3ccc(-c4ccc5c(c4)c4cc(-c6cccc(-c7cc8ccc(N(CC)CC)cc8oc7=O)c6)ccc4n5-c4ccccc4)cc3)c(=O)oc2c1.O=c1oc2ccc3ccccc3c2cc1-c1ccc2c(c1)c1cc(-c3cc4c(ccc5ccccc54)oc3=O)ccc1n2-c1ccccc1.

What is the InChIKey of 7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one?

The InChIKey is RWYJIMFNACRYCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H63N3O4.C56H47N3O4.C44H25NO4/c1-65(2)25-29-69-31-27-67(5,6)57-59(69)53(65)38-46-36-49(63(72)74-61(46)57)41-19-17-40(18-20-41)43-21-23-55-51(34-43)52-35-44(22-24-56(52)71(55)48-15-10-9-11-16-48)42-13-12-14-45(33-42)50-37-47-39-54-60-58(62(47)75-64(50)73)68(7,8)28-32-70(60)30-26-66(54,3)4;1-5-57(6-2)45-25-21-42-32-47(55(60)62-53(42)34-45)37-19-17-36(18-20-37)39-23-27-51-49(30-39)50-31-40(24-28-52(50)59(51)44-15-10-9-11-16-44)38-13-12-14-41(29-38)48-33-43-22-26-46(58(7-3)8-4)35-54(43)63-56(48)61;46-43-33(24-37-31-12-6-4-8-26(31)16-20-41(37)48-43)28-14-18-39-35(22-28)36-23-29(15-19-40(36)45(39)30-10-2-1-3-11-30)34-25-38-32-13-7-5-9-27(32)17-21-42(38)49-44(34)47/h9-24,33-39H,25-32H2,1-8H3;9-35H,5-8H2,1-4H3;1-25H.

What are the key properties of 7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one?

7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one has a molecular weight of 2443.96 g/mol, XLogP of 40.00, 19 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(diethylamino)-3-[4-[6-[3-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]chromen-2-one;2-[6-(3-oxobenzo[f]chromen-2-yl)-9-phenylcarbazol-3-yl]benzo[f]chromen-3-one;10,10,16,16-tetramethyl-5-[4-[9-phenyl-6-[3-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)phenyl]carbazol-3-yl]phenyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one is sourced from PubChem (CID 160752011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).