heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene

C348H294N21O21SSi+21 — CID 157306829

IUPACheptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene
SMILESCSc1ccc2ccc3ccc[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(-c4ccccc4)c4c3c2[n+]1CO4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C4(C)CCCCC4)c4c3c2[n+]1CO4.Cc1ccc2ccc3ccc([Si](C)(c4ccccc4)c4ccccc4)c4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4
InChIInChI=1S/C28H24NOSi.C22H24NO.C21H16NO.7C16H14NO.C15H12NOS.10C15H12NO/c1-20-13-14-22-16-15-21-17-18-25(28-26(21)27(22)29(20)19-30-28)31(2,23-9-5-3-6-10-23)24-11-7-4-8-12-24;1-15-6-7-17-9-8-16-10-11-18(22(2)12-4-3-5-13-22)21-19(16)20(17)23(15)14-24-21;1-14-7-8-17-10-9-16-11-12-18(15-5-3-2-4-6-15)21-19(16)20(17)22(14)13-23-21;7*1-10-3-5-12-7-8-13-6-4-11(2)17-9-18-16(10)14(12)15(13)17;1-18-12-7-6-10-4-5-11-3-2-8-16-9-17-15(12)13(10)14(11)16;10*1-10-5-6-12-8-7-11-3-2-4-13-14(11)15(12)16(10)9-17-13/h3-18H,19H2,1-2H3;6-11H,3-5,12-14H2,1-2H3;2-12H,13H2,1H3;7*3-8H,9H2,1-2H3;2-8H,9H2,1H3;10*2-8H,9H2,1H3/q21*+1
InChIKeyJFBYVIOYHFZJKI-UHFFFAOYSA-N
MW5166.46 g/mol
LogP69.28
Rot. Bonds6

About heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene

heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene (PubChem CID 157306829) has the molecular formula C348H294N21O21SSi+21 and a molecular weight of 5166.46 g/mol. Its IUPAC name is heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene.

Molecular Properties

Compound Nameheptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene
PubChem CID157306829
Molecular FormulaC348H294N21O21SSi+21
Molecular Weight5166.46 g/mol
Exact Mass5162.20
IUPAC Nameheptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene
SMILESCSc1ccc2ccc3ccc[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(-c4ccccc4)c4c3c2[n+]1CO4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C4(C)CCCCC4)c4c3c2[n+]1CO4.Cc1ccc2ccc3ccc([Si](C)(c4ccccc4)c4ccccc4)c4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4
InChIInChI=1S/C28H24NOSi.C22H24NO.C21H16NO.7C16H14NO.C15H12NOS.10C15H12NO/c1-20-13-14-22-16-15-21-17-18-25(28-26(21)27(22)29(20)19-30-28)31(2,23-9-5-3-6-10-23)24-11-7-4-8-12-24;1-15-6-7-17-9-8-16-10-11-18(22(2)12-4-3-5-13-22)21-19(16)20(17)23(15)14-24-21;1-14-7-8-17-10-9-16-11-12-18(15-5-3-2-4-6-15)21-19(16)20(17)22(14)13-23-21;7*1-10-3-5-12-7-8-13-6-4-11(2)17-9-18-16(10)14(12)15(13)17;1-18-12-7-6-10-4-5-11-3-2-8-16-9-17-15(12)13(10)14(11)16;10*1-10-5-6-12-8-7-11-3-2-4-13-14(11)15(12)16(10)9-17-13/h3-18H,19H2,1-2H3;6-11H,3-5,12-14H2,1-2H3;2-12H,13H2,1H3;7*3-8H,9H2,1-2H3;2-8H,9H2,1H3;10*2-8H,9H2,1H3/q21*+1
InChIKeyJFBYVIOYHFZJKI-UHFFFAOYSA-N
XLogP69.28
TPSA275.31 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds6
Heavy Atoms392
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005166.46
LogP ≤ 569.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene?
The IUPAC name of heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene (CID 157306829) is heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene.
What is the SMILES notation for heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene?
The canonical SMILES for heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene is CSc1ccc2ccc3ccc[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(-c4ccccc4)c4c3c2[n+]1CO4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C)[n+]4c3c2c1OC4.Cc1ccc2ccc3ccc(C4(C)CCCCC4)c4c3c2[n+]1CO4.Cc1ccc2ccc3ccc([Si](C)(c4ccccc4)c4ccccc4)c4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.Cc1ccc2ccc3cccc4c3c2[n+]1CO4.
What is the InChIKey of heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene?
The InChIKey is JFBYVIOYHFZJKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24NOSi.C22H24NO.C21H16NO.7C16H14NO.C15H12NOS.10C15H12NO/c1-20-13-14-22-16-15-21-17-18-25(28-26(21)27(22)29(20)19-30-28)31(2,23-9-5-3-6-10-23)24-11-7-4-8-12-24;1-15-6-7-17-9-8-16-10-11-18(22(2)12-4-3-5-13-22)21-19(16)20(17)23(15)14-24-21;1-14-7-8-17-10-9-16-11-12-18(15-5-3-2-4-6-15)21-19(16)20(17)22(14)13-23-21;7*1-10-3-5-12-7-8-13-6-4-11(2)17-9-18-16(10)14(12)15(13)17;1-18-12-7-6-10-4-5-11-3-2-8-16-9-17-15(12)13(10)14(11)16;10*1-10-5-6-12-8-7-11-3-2-4-13-14(11)15(12)16(10)9-17-13/h3-18H,19H2,1-2H3;6-11H,3-5,12-14H2,1-2H3;2-12H,13H2,1H3;7*3-8H,9H2,1-2H3;2-8H,9H2,1H3;10*2-8H,9H2,1H3/q21*+1.
What are the key properties of heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene?
heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene has a molecular weight of 5166.46 g/mol, XLogP of 69.28, 6 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for heptakis(5,14-dimethyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-(1-methylcyclohexyl)-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;methyl-(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-5-yl)-diphenylsilane;decakis(14-methyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene);14-methyl-5-phenyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene;5-methylsulfanyl-3-oxa-1-azoniatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaene is sourced from PubChem (CID 157306829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).