(diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane

C27H37I109N4-10 — CID 158561709

IUPAC(diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane
SMILESCC(C)N1C(C)([I-]I)C2(C(I(I)I(I)I(I)I(I)I(I)I)(I(I)I(I)I(I)I(I)I(I)[I-]I)N(C(C)C)C(I(I)I(I)I)(I(I)I(I)[I-]I)C2(C)I(I)[I-]I)C(I(I)I(I)I(I)I(I)I)(I(I)I(I)I(I)I(I)[I-]I)C1(I(I)I(I)I(I)I)I(I)I(I)I(I)[I-]I.CC(C)N1C(C)([I-]I)C2(C(I(I)I)(I(I)[I-]I)N(C(C)C)C2(I(I)I(I)I(I)I)I(I)I(I)I(I)[I-]I)C1(I(I)I(I)I)I(I)I(I)[I-]I
InChIInChI=1S/C15H20I74N2.C12H17I35N2/c1-7(2)90-10(6,55-16)11(12(62(23)80(45)84(49)72(35)36,63(24)81(46)86(51)76(41)59-20)15(90,68(29)78(43)71(33)34)69(30)79(44)75(40)58-19)9(5,61(22)56-17)13(64(25)70(31)32,65(26)74(39)57-18)91(8(3)4)14(11,66(27)82(47)88(53)85(50)73(37)38)67(28)83(48)89(54)87(52)77(42)60-21;1-6(2)48-8(5,32-13)9(11(48,38(20)42(24)25)39(21)44(28)34-15)10(36(17)18,37(19)33-14)49(7(3)4)12(9,40(22)46(30)43(26)27)41(23)47(31)45(29)35-16/h7-8H,1-6H3;6-7H,1-5H3/q-6;-4
InChIKeyMCJHZPYZVSCOLF-UHFFFAOYSA-N
MW14250.16 g/mol
LogP59.71
Rot. Bonds55

About (diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane

(diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane (PubChem CID 158561709) has the molecular formula C27H37I109N4-10 and a molecular weight of 14250.16 g/mol. Its IUPAC name is (diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane.

Molecular Properties

Compound Name(diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane
PubChem CID158561709
Molecular FormulaC27H37I109N4-10
Molecular Weight14250.16 g/mol
Exact Mass14249.89
IUPAC Name(diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane
SMILESCC(C)N1C(C)([I-]I)C2(C(I(I)I(I)I(I)I(I)I(I)I)(I(I)I(I)I(I)I(I)I(I)[I-]I)N(C(C)C)C(I(I)I(I)I)(I(I)I(I)[I-]I)C2(C)I(I)[I-]I)C(I(I)I(I)I(I)I(I)I)(I(I)I(I)I(I)I(I)[I-]I)C1(I(I)I(I)I(I)I)I(I)I(I)I(I)[I-]I.CC(C)N1C(C)([I-]I)C2(C(I(I)I)(I(I)[I-]I)N(C(C)C)C2(I(I)I(I)I(I)I)I(I)I(I)I(I)[I-]I)C1(I(I)I(I)I)I(I)I(I)[I-]I
InChIInChI=1S/C15H20I74N2.C12H17I35N2/c1-7(2)90-10(6,55-16)11(12(62(23)80(45)84(49)72(35)36,63(24)81(46)86(51)76(41)59-20)15(90,68(29)78(43)71(33)34)69(30)79(44)75(40)58-19)9(5,61(22)56-17)13(64(25)70(31)32,65(26)74(39)57-18)91(8(3)4)14(11,66(27)82(47)88(53)85(50)73(37)38)67(28)83(48)89(54)87(52)77(42)60-21;1-6(2)48-8(5,32-13)9(11(48,38(20)42(24)25)39(21)44(28)34-15)10(36(17)18,37(19)33-14)49(7(3)4)12(9,40(22)46(30)43(26)27)41(23)47(31)45(29)35-16/h7-8H,1-6H3;6-7H,1-5H3/q-6;-4
InChIKeyMCJHZPYZVSCOLF-UHFFFAOYSA-N
XLogP59.71
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds55
Heavy Atoms140
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 50014250.16
LogP ≤ 559.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze (diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane 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 (diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane?
The IUPAC name of (diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane (CID 158561709) is (diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane.
What is the SMILES notation for (diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane?
The canonical SMILES for (diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane is CC(C)N1C(C)([I-]I)C2(C(I(I)I(I)I(I)I(I)I(I)I)(I(I)I(I)I(I)I(I)I(I)[I-]I)N(C(C)C)C(I(I)I(I)I)(I(I)I(I)[I-]I)C2(C)I(I)[I-]I)C(I(I)I(I)I(I)I(I)I)(I(I)I(I)I(I)I(I)[I-]I)C1(I(I)I(I)I(I)I)I(I)I(I)I(I)[I-]I.CC(C)N1C(C)([I-]I)C2(C(I(I)I)(I(I)[I-]I)N(C(C)C)C2(I(I)I(I)I(I)I)I(I)I(I)I(I)[I-]I)C1(I(I)I(I)I)I(I)I(I)[I-]I.
What is the InChIKey of (diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane?
The InChIKey is MCJHZPYZVSCOLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20I74N2.C12H17I35N2/c1-7(2)90-10(6,55-16)11(12(62(23)80(45)84(49)72(35)36,63(24)81(46)86(51)76(41)59-20)15(90,68(29)78(43)71(33)34)69(30)79(44)75(40)58-19)9(5,61(22)56-17)13(64(25)70(31)32,65(26)74(39)57-18)91(8(3)4)14(11,66(27)82(47)88(53)85(50)73(37)38)67(28)83(48)89(54)87(52)77(42)60-21;1-6(2)48-8(5,32-13)9(11(48,38(20)42(24)25)39(21)44(28)34-15)10(36(17)18,37(19)33-14)49(7(3)4)12(9,40(22)46(30)43(26)27)41(23)47(31)45(29)35-16/h7-8H,1-6H3;6-7H,1-5H3/q-6;-4.
What are the key properties of (diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane?
(diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane has a molecular weight of 14250.16 g/mol, XLogP of 59.71, 55 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (diiodo-λ3-iodanyl)-[[1-(diiodo-λ3-iodanyl)-7-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-5-iodoiodanuidyl-1-[iodo(iodoiodanuidyl)-λ3-iodanyl]-7-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-3-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-5-methyl-2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptan-3-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodane;(diiodo-λ3-iodanyl)-[[[[3-[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-8-[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-9-[[[(diiodo-λ3-iodanyl)-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-6-iodoiodanuidyl-4-[iodo(iodoiodanuidyl)-λ3-iodanyl]-3-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-8-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-9-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-1-[iodo-[iodo-[iodo-[iodo-[iodo(iodoiodanuidyl)-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-λ3-iodanyl]-4,6-dimethyl-2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonan-1-yl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodanyl]-iodo-λ3-iodane is sourced from PubChem (CID 158561709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).