22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine

C354H234B6F5N15S3 — CID 165053072

About 22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine

22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine (PubChem CID 165053072) has the molecular formula C354H234B6F5N15S3 and a molecular weight of 4953.93 g/mol. Its IUPAC name is 22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine.

Molecular Properties

• Compound Name: 22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine
• PubChem CID: 165053072
• Molecular Formula: C354H234B6F5N15S3
• Molecular Weight: 4953.93 g/mol
• Exact Mass: 4950.84
• IUPAC Name: 22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine
• SMILES: Fc1cc(F)c(N2c3cc4c(cc3B3c5ccccc5N(c5c(-c6ccccc6)cccc5-c5ccccc5)c5cc(N(c6ccccc6)c6c(-c7ccccc7)cccc6-c6ccccc6)cc2c53)B2c3ccccc3N(c3c(-c5ccccc5)cccc3-c3ccccc3)c3cc(N(c5ccccc5)c5c(-c6ccccc6)cccc5-c5ccccc5)cc(c32)S4)c(-c2ccccc2)c1.Fc1cc(F)c(N2c3cc4c(cc3B3c5ccccc5N(c5c(-c6ccccc6)cccc5-c5ccccc5)c5cc(N(c6ccccc6)c6c(-c7ccccc7)cccc6-c6ccccc6)cc2c53)B2c3ccccc3N(c3ccccc3)c3cc(N(c5ccccc5)c5ccccc5)cc(c32)S4)c(-c2ccccc2)c1.Fc1cccc(-c2ccccc2)c1N1c2cc3c(cc2B2c4ccccc4N(c4c(-c5ccccc5)cccc4-c4ccccc4)c4cc(N(c5ccccc5)c5c(-c6ccccc6)cccc5-c5ccccc5)cc1c42)B1c2ccccc2N(c2c(-c4ccccc4)cccc2-c2ccccc2)c2cc(N(c4ccccc4)c4c(-c5ccccc5)cccc4-c4ccccc4)cc(c21)S3
• InChI: InChI=1S/C126H83B2F2N5S.C126H84B2FN5S.C102H67B2F2N5S/c129-93-76-106(92-58-28-9-29-59-92)126(111(130)77-93)135-114-83-118-110(128-108-73-35-37-75-113(108)134(125-104(90-54-24-7-25-55-90)70-41-71-105(125)91-56-26-8-27-57-91)117-80-97(81-119(136-118)121(117)128)132(95-62-32-11-33-63-95)123-100(86-46-16-3-17-47-86)66-39-67-101(123)87-48-18-4-19-49-87)82-109(114)127-107-72-34-36-74-112(107)133(124-102(88-50-20-5-21-51-88)68-40-69-103(124)89-52-22-6-23-53-89)115-78-96(79-116(135)120(115)127)131(94-60-30-10-31-61-94)122-98(84-42-12-1-13-43-84)64-38-65-99(122)85-44-14-2-15-45-85;129-111-76-42-73-106(93-59-28-9-29-60-93)126(111)134-114-84-118-110(128-108-75-35-37-78-113(108)133(125-104(91-55-24-7-25-56-91)71-41-72-105(125)92-57-26-8-27-58-92)117-81-97(82-119(135-118)121(117)128)131(95-63-32-11-33-64-95)123-100(87-47-16-3-17-48-87)67-39-68-101(123)88-49-18-4-19-50-88)83-109(114)127-107-74-34-36-77-112(107)132(124-102(89-51-20-5-21-52-89)69-40-70-103(124)90-53-22-6-23-54-90)115-79-96(80-116(134)120(115)127)130(94-61-30-10-31-62-94)122-98(85-43-12-1-13-44-85)65-38-66-99(122)86-45-14-2-15-46-86;105-73-60-84(72-42-18-5-19-43-72)102(89(106)61-73)111-92-67-96-88(104-85-56-28-30-58-90(85)109(77-50-26-9-27-51-77)95-64-79(65-97(112-96)99(95)104)107(74-44-20-6-21-45-74)75-46-22-7-23-47-75)66-87(92)103-86-57-29-31-59-91(86)110(101-82(70-38-14-3-15-39-70)54-33-55-83(101)71-40-16-4-17-41-71)93-62-78(63-94(111)98(93)103)108(76-48-24-8-25-49-76)100-80(68-34-10-1-11-35-68)52-32-53-81(100)69-36-12-2-13-37-69/h1-83H;1-84H;1-67H
• InChIKey: PZAWEFLAZLPTKH-UHFFFAOYSA-N
• XLogP: 85.45
• TPSA: 48.60 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 50
• Heavy Atoms: 383
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4953.93
LogP ≤ 5	85.45
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of 22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine?

The IUPAC name of 22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine (CID 165053072) is 22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine.

What is the SMILES notation for 22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine?

The canonical SMILES for 22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine is Fc1cc(F)c(N2c3cc4c(cc3B3c5ccccc5N(c5c(-c6ccccc6)cccc5-c5ccccc5)c5cc(N(c6ccccc6)c6c(-c7ccccc7)cccc6-c6ccccc6)cc2c53)B2c3ccccc3N(c3c(-c5ccccc5)cccc3-c3ccccc3)c3cc(N(c5ccccc5)c5c(-c6ccccc6)cccc5-c5ccccc5)cc(c32)S4)c(-c2ccccc2)c1.Fc1cc(F)c(N2c3cc4c(cc3B3c5ccccc5N(c5c(-c6ccccc6)cccc5-c5ccccc5)c5cc(N(c6ccccc6)c6c(-c7ccccc7)cccc6-c6ccccc6)cc2c53)B2c3ccccc3N(c3ccccc3)c3cc(N(c5ccccc5)c5ccccc5)cc(c32)S4)c(-c2ccccc2)c1.Fc1cccc(-c2ccccc2)c1N1c2cc3c(cc2B2c4ccccc4N(c4c(-c5ccccc5)cccc4-c4ccccc4)c4cc(N(c5ccccc5)c5c(-c6ccccc6)cccc5-c5ccccc5)cc1c42)B1c2ccccc2N(c2c(-c4ccccc4)cccc2-c2ccccc2)c2cc(N(c4ccccc4)c4c(-c5ccccc5)cccc4-c4ccccc4)cc(c21)S3.

What is the InChIKey of 22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine?

The InChIKey is PZAWEFLAZLPTKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C126H83B2F2N5S.C126H84B2FN5S.C102H67B2F2N5S/c129-93-76-106(92-58-28-9-29-59-92)126(111(130)77-93)135-114-83-118-110(128-108-73-35-37-75-113(108)134(125-104(90-54-24-7-25-55-90)70-41-71-105(125)91-56-26-8-27-57-91)117-80-97(81-119(136-118)121(117)128)132(95-62-32-11-33-63-95)123-100(86-46-16-3-17-47-86)66-39-67-101(123)87-48-18-4-19-49-87)82-109(114)127-107-72-34-36-74-112(107)133(124-102(88-50-20-5-21-51-88)68-40-69-103(124)89-52-22-6-23-53-89)115-78-96(79-116(135)120(115)127)131(94-60-30-10-31-61-94)122-98(84-42-12-1-13-43-84)64-38-65-99(122)85-44-14-2-15-45-85;129-111-76-42-73-106(93-59-28-9-29-60-93)126(111)134-114-84-118-110(128-108-75-35-37-78-113(108)133(125-104(91-55-24-7-25-56-91)71-41-72-105(125)92-57-26-8-27-58-92)117-81-97(82-119(135-118)121(117)128)131(95-63-32-11-33-64-95)123-100(87-47-16-3-17-48-87)67-39-68-101(123)88-49-18-4-19-50-88)83-109(114)127-107-74-34-36-77-112(107)132(124-102(89-51-20-5-21-52-89)69-40-70-103(124)90-53-22-6-23-54-90)115-79-96(80-116(134)120(115)127)130(94-61-30-10-31-62-94)122-98(85-43-12-1-13-44-85)65-38-66-99(122)86-45-14-2-15-46-86;105-73-60-84(72-42-18-5-19-43-72)102(89(106)61-73)111-92-67-96-88(104-85-56-28-30-58-90(85)109(77-50-26-9-27-51-77)95-64-79(65-97(112-96)99(95)104)107(74-44-20-6-21-45-74)75-46-22-7-23-47-75)66-87(92)103-86-57-29-31-59-91(86)110(101-82(70-38-14-3-15-39-70)54-33-55-83(101)71-40-16-4-17-41-71)93-62-78(63-94(111)98(93)103)108(76-48-24-8-25-49-76)100-80(68-34-10-1-11-35-68)52-32-53-81(100)69-36-12-2-13-37-69/h1-83H;1-84H;1-67H.

What are the key properties of 22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine?

22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine has a molecular weight of 4953.93 g/mol, XLogP of 85.45, 50 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 22-(2,4-difluoro-6-phenylphenyl)-25-N,28-bis(2,6-diphenylphenyl)-15-N,15-N,25-N,12-tetraphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;22-(2,4-difluoro-6-phenylphenyl)-15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine;15-N,25-N,12,28-tetrakis(2,6-diphenylphenyl)-22-(2-fluoro-6-phenylphenyl)-15-N,25-N-diphenyl-18-thia-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine is sourced from PubChem (CID 165053072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).