7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine

C335H246N12O11 — CID 167591830

About 7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine

7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine (PubChem CID 167591830) has the molecular formula C335H246N12O11 and a molecular weight of 4615.73 g/mol. Its IUPAC name is 7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine.

Molecular Properties

• Compound Name: 7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine
• PubChem CID: 167591830
• Molecular Formula: C335H246N12O11
• Molecular Weight: 4615.73 g/mol
• Exact Mass: 4611.91
• IUPAC Name: 7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine
• SMILES: CC(C)(C)c1cccc2c1oc1c(N(c3ccccc3)c3ccc4cc5c(cc4c3)oc3cc4cc(N(c6ccccc6)c6cccc7c6oc6c(C(C)(C)C)cccc67)ccc4cc35)cccc12.Cc1cccc(N(c2cccc3c2Cc2c-3cccc2C(C)(C)C)c2cc3c(oc4cc(N(c5cccc(C)c5)c5cccc6c5oc5c(C(C)(C)C)cccc56)c5ccccc5c43)c3ccccc23)c1.Cc1cccc(N(c2ccccc2C)c2cc3c4cc(N(c5cccc(C)c5)c5ccccc5C)c5ccccc5c4oc3c3ccccc23)c1.c1ccc(-c2cccc3c2oc2c(N(c4ccccc4)c4ccc5cc6c(cc5c4)oc4cc5cc(N(c7ccccc7)c7cccc8c7oc7c(-c9ccccc9)cccc78)ccc5cc46)cccc23)cc1.c1ccc(N(c2ccccc2)c2cc3c(oc4cc(N(c5ccccc5)c5ccccc5)c5ccccc5c43)c3ccccc23)cc1.c1ccc(N(c2ccccc2)c2cc3c4cc(N(c5ccccc5)c5ccccc5)c5ccccc5c4oc3c3ccccc23)cc1
• InChI: InChI=1S/C68H42N2O3.C67H56N2O2.C64H50N2O3.C48H38N2O.2C44H30N2O/c1-5-17-43(18-6-1)53-25-13-27-55-57-29-15-31-61(67(57)72-65(53)55)69(49-21-9-3-10-22-49)51-35-33-45-39-59-60-40-46-34-36-52(38-48(46)42-64(60)71-63(59)41-47(45)37-51)70(50-23-11-4-12-24-50)62-32-16-30-58-56-28-14-26-54(66(56)73-68(58)62)44-19-7-2-8-20-44;1-40-19-13-21-42(35-40)68(57-33-17-28-45-44-27-15-31-55(66(3,4)5)52(44)37-53(45)57)59-38-54-62-48-25-11-9-23-46(48)60(39-61(62)70-63(54)49-26-12-10-24-47(49)59)69(43-22-14-20-41(2)36-43)58-34-18-30-51-50-29-16-32-56(67(6,7)8)64(50)71-65(51)58;1-63(2,3)53-25-13-21-47-49-23-15-27-55(61(49)68-59(47)53)65(43-17-9-7-10-18-43)45-31-29-39-35-51-52-36-40-30-32-46(34-42(40)38-58(52)67-57(51)37-41(39)33-45)66(44-19-11-8-12-20-44)56-28-16-24-50-48-22-14-26-54(64(4,5)6)60(48)69-62(50)56;1-31-15-13-19-35(27-31)49(43-25-11-5-17-33(43)3)45-29-41-42-30-46(50(36-20-14-16-32(2)28-36)44-26-12-6-18-34(44)4)38-22-8-10-24-40(38)48(42)51-47(41)39-23-9-7-21-37(39)45;1-5-17-31(18-6-1)45(32-19-7-2-8-20-32)41-29-39-40-30-42(46(33-21-9-3-10-22-33)34-23-11-4-12-24-34)36-26-14-16-28-38(36)44(40)47-43(39)37-27-15-13-25-35(37)41;1-5-17-31(18-6-1)45(32-19-7-2-8-20-32)40-29-39-43-37-27-15-13-25-35(37)41(30-42(43)47-44(39)38-28-16-14-26-36(38)40)46(33-21-9-3-10-22-33)34-23-11-4-12-24-34/h1-42H;9-36,38-39H,37H2,1-8H3;7-38H,1-6H3;5-30H,1-4H3;2*1-30H
• InChIKey: INQIAYKXHIHTDP-UHFFFAOYSA-N
• XLogP: 98.43
• TPSA: 183.42 Ų
• H-Bond Acceptors: 23
• Rotatable Bonds: 38
• Heavy Atoms: 358
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4615.73
LogP ≤ 5	98.43
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of 7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine?

The IUPAC name of 7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine (CID 167591830) is 7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine.

What is the SMILES notation for 7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine?

The canonical SMILES for 7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine is CC(C)(C)c1cccc2c1oc1c(N(c3ccccc3)c3ccc4cc5c(cc4c3)oc3cc4cc(N(c6ccccc6)c6cccc7c6oc6c(C(C)(C)C)cccc67)ccc4cc35)cccc12.Cc1cccc(N(c2cccc3c2Cc2c-3cccc2C(C)(C)C)c2cc3c(oc4cc(N(c5cccc(C)c5)c5cccc6c5oc5c(C(C)(C)C)cccc56)c5ccccc5c43)c3ccccc23)c1.Cc1cccc(N(c2ccccc2C)c2cc3c4cc(N(c5cccc(C)c5)c5ccccc5C)c5ccccc5c4oc3c3ccccc23)c1.c1ccc(-c2cccc3c2oc2c(N(c4ccccc4)c4ccc5cc6c(cc5c4)oc4cc5cc(N(c7ccccc7)c7cccc8c7oc7c(-c9ccccc9)cccc78)ccc5cc46)cccc23)cc1.c1ccc(N(c2ccccc2)c2cc3c(oc4cc(N(c5ccccc5)c5ccccc5)c5ccccc5c43)c3ccccc23)cc1.c1ccc(N(c2ccccc2)c2cc3c4cc(N(c5ccccc5)c5ccccc5)c5ccccc5c4oc3c3ccccc23)cc1.

What is the InChIKey of 7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine?

The InChIKey is INQIAYKXHIHTDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H42N2O3.C67H56N2O2.C64H50N2O3.C48H38N2O.2C44H30N2O/c1-5-17-43(18-6-1)53-25-13-27-55-57-29-15-31-61(67(57)72-65(53)55)69(49-21-9-3-10-22-49)51-35-33-45-39-59-60-40-46-34-36-52(38-48(46)42-64(60)71-63(59)41-47(45)37-51)70(50-23-11-4-12-24-50)62-32-16-30-58-56-28-14-26-54(66(56)73-68(58)62)44-19-7-2-8-20-44;1-40-19-13-21-42(35-40)68(57-33-17-28-45-44-27-15-31-55(66(3,4)5)52(44)37-53(45)57)59-38-54-62-48-25-11-9-23-46(48)60(39-61(62)70-63(54)49-26-12-10-24-47(49)59)69(43-22-14-20-41(2)36-43)58-34-18-30-51-50-29-16-32-56(67(6,7)8)64(50)71-65(51)58;1-63(2,3)53-25-13-21-47-49-23-15-27-55(61(49)68-59(47)53)65(43-17-9-7-10-18-43)45-31-29-39-35-51-52-36-40-30-32-46(34-42(40)38-58(52)67-57(51)37-41(39)33-45)66(44-19-11-8-12-20-44)56-28-16-24-50-48-22-14-26-54(64(4,5)6)60(48)69-62(50)56;1-31-15-13-19-35(27-31)49(43-25-11-5-17-33(43)3)45-29-41-42-30-46(50(36-20-14-16-32(2)28-36)44-26-12-6-18-34(44)4)38-22-8-10-24-40(38)48(42)51-47(41)39-23-9-7-21-37(39)45;1-5-17-31(18-6-1)45(32-19-7-2-8-20-32)41-29-39-40-30-42(46(33-21-9-3-10-22-33)34-23-11-4-12-24-34)36-26-14-16-28-38(36)44(40)47-43(39)37-27-15-13-25-35(37)41;1-5-17-31(18-6-1)45(32-19-7-2-8-20-32)40-29-39-43-37-27-15-13-25-35(37)41(30-42(43)47-44(39)38-28-16-14-26-36(38)40)46(33-21-9-3-10-22-33)34-23-11-4-12-24-34/h1-42H;9-36,38-39H,37H2,1-8H3;7-38H,1-6H3;5-30H,1-4H3;2*1-30H.

What are the key properties of 7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine?

7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine has a molecular weight of 4615.73 g/mol, XLogP of 98.43, 38 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 7-N,17-N-bis(6-tert-butyldibenzofuran-4-yl)-7-N,17-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N-(6-tert-butyldibenzofuran-4-yl)-20-N-(8-tert-butyl-9H-fluoren-1-yl)-9-N,20-N-bis(3-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;7-N,17-N-diphenyl-7-N,17-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-7,17-diamine;4-N,4-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,20-N,20-N-tetraphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine is sourced from PubChem (CID 167591830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).