5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one

C288H173N17O11S7 — CID 157257352

About 5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one

5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one (PubChem CID 157257352) has the molecular formula C288H173N17O11S7 and a molecular weight of 4272.13 g/mol. Its IUPAC name is 5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one.

Molecular Properties

• Compound Name: 5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one
• PubChem CID: 157257352
• Molecular Formula: C288H173N17O11S7
• Molecular Weight: 4272.13 g/mol
• Exact Mass: 4268.15
• IUPAC Name: 5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one
• SMILES: O=S1(=O)c2ccccc2-c2cc(-n3c4ccccc4c4ccccc43)cc3c2N1c1ccccc1N3c1ccccc1.O=S1(=O)c2ccccc2-c2cc(-n3c4ccccc4c4ccccc43)cc3c2N1c1ccccc1S3.O=c1c2ccccc2c2cc(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)cc3c2n1-c1ccccc1S3.O=c1c2ccccc2c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc3c2n1-c1ccc(-c2ccc4c(c2)c2ccccc2n4-c2ccccc2)cc1S3.O=c1c2ccccc2c2cc(-c3ccc4sc5ccccc5c4c3)cc3c4ccccc4n1c23.O=c1c2ccccc2c2cc(-n3c4ccccc4c4ccccc43)cc3c2n1-c1ccccc1N3c1ccccc1.O=c1c2ccccc2c2cc(-n3c4ccccc4c4ccccc43)cc3c2n1-c1ccccc1O3.O=c1c2ccccc2c2cc(-n3c4ccccc4c4ccccc43)cc3c2n1-c1ccccc1S3
• InChI: InChI=1S/C55H33N3OS.C37H23N3O.C37H23NOS.C36H23N3O2S.C31H18N2O2.C31H18N2OS.C31H17NOS.C30H18N2O2S2/c59-55-43-20-8-7-17-40(43)46-31-37(35-24-27-50-45(30-35)42-19-10-12-22-48(42)57(50)39-15-5-2-6-16-39)33-53-54(46)58(55)51-28-25-36(32-52(51)60-53)34-23-26-49-44(29-34)41-18-9-11-21-47(41)56(49)38-13-3-1-4-14-38;41-37-29-17-5-4-14-26(29)30-22-25(39-31-18-8-6-15-27(31)28-16-7-9-19-32(28)39)23-35-36(30)40(37)34-21-11-10-20-33(34)38(35)24-12-2-1-3-13-24;39-37-31-16-8-7-15-30(31)32-22-29(23-35-36(32)38(37)33-17-9-10-18-34(33)40-35)28-20-26(24-11-3-1-4-12-24)19-27(21-28)25-13-5-2-6-14-25;40-42(41)35-21-11-6-16-28(35)29-22-25(38-30-17-7-4-14-26(30)27-15-5-8-18-31(27)38)23-34-36(29)39(42)33-20-10-9-19-32(33)37(34)24-12-2-1-3-13-24;2*34-31-23-12-2-1-9-20(23)24-17-19(18-29-30(24)33(31)27-15-7-8-16-28(27)35-29)32-25-13-5-3-10-21(25)22-11-4-6-14-26(22)32;33-31-23-10-2-1-7-20(23)25-16-19(17-26-21-8-3-5-11-27(21)32(31)30(25)26)18-13-14-29-24(15-18)22-9-4-6-12-28(22)34-29;33-36(34)29-16-8-3-11-22(29)23-17-19(18-28-30(23)32(36)26-14-6-7-15-27(26)35-28)31-24-12-4-1-9-20(24)21-10-2-5-13-25(21)31/h1-33H;1-23H;1-23H;1-23H;2*1-18H;1-17H;1-18H
• InChIKey: AXAVNNBKSONLIY-UHFFFAOYSA-N
• XLogP: 72.88
• TPSA: 256.46 Ų
• H-Bond Acceptors: 31
• Rotatable Bonds: 15
• Heavy Atoms: 323
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4272.13
LogP ≤ 5	72.88
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one?

The IUPAC name of 5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one (CID 157257352) is 5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one.

What is the SMILES notation for 5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one?

The canonical SMILES for 5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one is O=S1(=O)c2ccccc2-c2cc(-n3c4ccccc4c4ccccc43)cc3c2N1c1ccccc1N3c1ccccc1.O=S1(=O)c2ccccc2-c2cc(-n3c4ccccc4c4ccccc43)cc3c2N1c1ccccc1S3.O=c1c2ccccc2c2cc(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)cc3c2n1-c1ccccc1S3.O=c1c2ccccc2c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc3c2n1-c1ccc(-c2ccc4c(c2)c2ccccc2n4-c2ccccc2)cc1S3.O=c1c2ccccc2c2cc(-c3ccc4sc5ccccc5c4c3)cc3c4ccccc4n1c23.O=c1c2ccccc2c2cc(-n3c4ccccc4c4ccccc43)cc3c2n1-c1ccccc1N3c1ccccc1.O=c1c2ccccc2c2cc(-n3c4ccccc4c4ccccc43)cc3c2n1-c1ccccc1O3.O=c1c2ccccc2c2cc(-n3c4ccccc4c4ccccc43)cc3c2n1-c1ccccc1S3.

What is the InChIKey of 5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one?

The InChIKey is AXAVNNBKSONLIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H33N3OS.C37H23N3O.C37H23NOS.C36H23N3O2S.C31H18N2O2.C31H18N2OS.C31H17NOS.C30H18N2O2S2/c59-55-43-20-8-7-17-40(43)46-31-37(35-24-27-50-45(30-35)42-19-10-12-22-48(42)57(50)39-15-5-2-6-16-39)33-53-54(46)58(55)51-28-25-36(32-52(51)60-53)34-23-26-49-44(29-34)41-18-9-11-21-47(41)56(49)38-13-3-1-4-14-38;41-37-29-17-5-4-14-26(29)30-22-25(39-31-18-8-6-15-27(31)28-16-7-9-19-32(28)39)23-35-36(30)40(37)34-21-11-10-20-33(34)38(35)24-12-2-1-3-13-24;39-37-31-16-8-7-15-30(31)32-22-29(23-35-36(32)38(37)33-17-9-10-18-34(33)40-35)28-20-26(24-11-3-1-4-12-24)19-27(21-28)25-13-5-2-6-14-25;40-42(41)35-21-11-6-16-28(35)29-22-25(38-30-17-7-4-14-26(30)27-15-5-8-18-31(27)38)23-34-36(29)39(42)33-20-10-9-19-32(33)37(34)24-12-2-1-3-13-24;2*34-31-23-12-2-1-9-20(23)24-17-19(18-29-30(24)33(31)27-15-7-8-16-28(27)35-29)32-25-13-5-3-10-21(25)22-11-4-6-14-26(22)32;33-31-23-10-2-1-7-20(23)25-16-19(17-26-21-8-3-5-11-27(21)32(31)30(25)26)18-13-14-29-24(15-18)22-9-4-6-12-28(22)34-29;33-36(34)29-16-8-3-11-22(29)23-17-19(18-28-30(23)32(36)26-14-6-7-15-27(26)35-28)31-24-12-4-1-9-20(24)21-10-2-5-13-25(21)31/h1-33H;1-23H;1-23H;1-23H;2*1-18H;1-17H;1-18H.

What are the key properties of 5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one?

5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one has a molecular weight of 4272.13 g/mol, XLogP of 72.88, 15 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 5,11-bis(9-phenylcarbazol-3-yl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2(7),3,5,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8,20λ6-dithia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;11-carbazol-9-yl-8-phenyl-20λ6-thia-1,8-diazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaene 20,20-dioxide;11-carbazol-9-yl-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one;10-dibenzothiophen-2-yl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8,10,12(20),13,15,17-nonaen-19-one;11-(3,5-diphenylphenyl)-8-thia-1-azapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-2,4,6,9,11,13(21),14,16,18-nonaen-20-one is sourced from PubChem (CID 157257352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).