About N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis[3,5-bis(2,4,6-trimethylphenyl)phenyl]-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis(3,5-ditert-butylphenyl)-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis(2-methoxypropanoylamino)phenyl]-10,20-bis(3,5-ditert-butylphenyl)porphyrin-22,24-diid-5-yl]-3-(2-methoxypropanoylamino)phenyl]-2-methoxypropanamide;cobalt(2+);bis(cobalt(3+));sulfane
N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis[3,5-bis(2,4,6-trimethylphenyl)phenyl]-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis(3,5-ditert-butylphenyl)-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis(2-methoxypropanoylamino)phenyl]-10,20-bis(3,5-ditert-butylphenyl)porphyrin-22,24-diid-5-yl]-3-(2-methoxypropanoylamino)phenyl]-2-methoxypropanamide;cobalt(2+);bis(cobalt(3+));sulfane (PubChem CID 158345258) has the molecular formula C264H306Co3N24O16S8
and a molecular weight of 4504.84 g/mol. Its IUPAC name is N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis[3,5-bis(2,4,6-trimethylphenyl)phenyl]-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis(3,5-ditert-butylphenyl)-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis(2-methoxypropanoylamino)phenyl]-10,20-bis(3,5-ditert-butylphenyl)porphyrin-22,24-diid-5-yl]-3-(2-methoxypropanoylamino)phenyl]-2-methoxypropanamide;cobalt(2+);bis(cobalt(3+));sulfane.
Frequently Asked Questions
What is the IUPAC name of N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis[3,5-bis(2,4,6-trimethylphenyl)phenyl]-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis(3,5-ditert-butylphenyl)-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis(2-methoxypropanoylamino)phenyl]-10,20-bis(3,5-ditert-butylphenyl)porphyrin-22,24-diid-5-yl]-3-(2-methoxypropanoylamino)phenyl]-2-methoxypropanamide;cobalt(2+);bis(cobalt(3+));sulfane?
The IUPAC name of N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis[3,5-bis(2,4,6-trimethylphenyl)phenyl]-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis(3,5-ditert-butylphenyl)-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis(2-methoxypropanoylamino)phenyl]-10,20-bis(3,5-ditert-butylphenyl)porphyrin-22,24-diid-5-yl]-3-(2-methoxypropanoylamino)phenyl]-2-methoxypropanamide;cobalt(2+);bis(cobalt(3+));sulfane (CID 158345258) is N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis[3,5-bis(2,4,6-trimethylphenyl)phenyl]-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis(3,5-ditert-butylphenyl)-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis(2-methoxypropanoylamino)phenyl]-10,20-bis(3,5-ditert-butylphenyl)porphyrin-22,24-diid-5-yl]-3-(2-methoxypropanoylamino)phenyl]-2-methoxypropanamide;cobalt(2+);bis(cobalt(3+));sulfane.
What is the SMILES notation for N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis[3,5-bis(2,4,6-trimethylphenyl)phenyl]-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis(3,5-ditert-butylphenyl)-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis(2-methoxypropanoylamino)phenyl]-10,20-bis(3,5-ditert-butylphenyl)porphyrin-22,24-diid-5-yl]-3-(2-methoxypropanoylamino)phenyl]-2-methoxypropanamide;cobalt(2+);bis(cobalt(3+));sulfane?
The canonical SMILES for N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis[3,5-bis(2,4,6-trimethylphenyl)phenyl]-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis(3,5-ditert-butylphenyl)-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis(2-methoxypropanoylamino)phenyl]-10,20-bis(3,5-ditert-butylphenyl)porphyrin-22,24-diid-5-yl]-3-(2-methoxypropanoylamino)phenyl]-2-methoxypropanamide;cobalt(2+);bis(cobalt(3+));sulfane is CC(C)(C)c1cc(C2=C3C=CC(=N3)C(c3c(NC(=O)C4CC4(C)C)cccc3NC(=O)C3CC3(C)C)=c3ccc([n-]3)=C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)C3C=CC(=C(c4c(NC(=O)C5CC5(C)C)cccc4NC(=O)C4CC4(C)C)c4ccc2[n-]4)[N-]3)cc(C(C)(C)C)c1.COC(C)C(=O)Nc1cccc(NC(=O)C(C)OC)c1-c1c2nc(c(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3)c3ccc([n-]3)c(-c3c(NC(=O)C(C)OC)cccc3NC(=O)C(C)OC)c3nc(c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4ccc1[n-]4)C=C3)C=C2.Cc1cc(C)c(-c2cc(C3=C4C=CC(=N4)C(c4c(NC(=O)C5CC5(C)C)cccc4NC(=O)C4CC4(C)C)=c4ccc([n-]4)=C(c4cc(-c5c(C)cc(C)cc5C)cc(-c5c(C)cc(C)cc5C)c4)C4C=CC(=C(c5c(NC(=O)C6CC6(C)C)cccc5NC(=O)C5CC5(C)C)c5ccc3[n-]5)[N-]4)cc(-c3c(C)cc(C)cc3C)c2)c(C)c1.S.S.S.S.S.S.S.S.[Co+2].[Co+3].[Co+3].
What is the InChIKey of N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis[3,5-bis(2,4,6-trimethylphenyl)phenyl]-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis(3,5-ditert-butylphenyl)-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis(2-methoxypropanoylamino)phenyl]-10,20-bis(3,5-ditert-butylphenyl)porphyrin-22,24-diid-5-yl]-3-(2-methoxypropanoylamino)phenyl]-2-methoxypropanamide;cobalt(2+);bis(cobalt(3+));sulfane?
The InChIKey is GRQQNQNFUGUNNE-CYBYTSPMSA-F. The full InChI is InChI=1S/C104H108N8O4.C84H100N8O4.C76H90N8O8.3Co.8H2S/c1-53-35-57(5)87(58(6)36-53)65-43-66(88-59(7)37-54(2)38-60(88)8)46-69(45-65)91-79-27-31-83(105-79)95(93-75(109-97(113)71-49-101(71,13)14)23-21-24-76(93)110-98(114)72-50-102(72,15)16)85-33-29-81(107-85)92(70-47-67(89-61(9)39-55(3)40-62(89)10)44-68(48-70)90-63(11)41-56(4)42-64(90)12)82-30-34-86(108-82)96(84-32-28-80(91)106-84)94-77(111-99(115)73-51-103(73,17)18)25-22-26-78(94)112-100(116)74-52-104(74,19)20;1-77(2,3)47-35-45(36-48(39-47)78(4,5)6)67-59-27-31-63(85-59)71(69-55(89-73(93)51-41-81(51,13)14)23-21-24-56(69)90-74(94)52-42-82(52,15)16)65-33-29-61(87-65)68(46-37-49(79(7,8)9)40-50(38-46)80(10,11)12)62-30-34-66(88-62)72(64-32-28-60(67)86-64)70-57(91-75(95)53-43-83(53,17)18)25-22-26-58(70)92-76(96)54-44-84(54,19)20;1-41(89-17)69(85)81-51-23-21-24-52(82-70(86)42(2)90-18)65(51)67-59-31-27-55(77-59)63(45-35-47(73(5,6)7)39-48(36-45)74(8,9)10)57-29-33-61(79-57)68(66-53(83-71(87)43(3)91-19)25-22-26-54(66)84-72(88)44(4)92-20)62-34-30-58(80-62)64(56-28-32-60(67)78-56)46-37-49(75(11,12)13)40-50(38-46)76(14,15)16;;;;;;;;;;;/h21-48,71-74,79H,49-52H2,1-20H3,(H7,105,106,107,108,109,110,111,112,113,114,115,116);21-40,51-54,59H,41-44H2,1-20H3,(H7,85,86,87,88,89,90,91,92,93,94,95,96);21-44H,1-20H3,(H6,77,78,79,80,81,82,83,84,85,86,87,88);;;;8*1H2/q;;;+2;2*+3;;;;;;;;/p-8/b;;63-55-,63-57-,64-56-,64-58-,67-59+,67-60+,68-61+,68-62+;;;;;;;;;;;.
What are the key properties of N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis[3,5-bis(2,4,6-trimethylphenyl)phenyl]-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis(3,5-ditert-butylphenyl)-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis(2-methoxypropanoylamino)phenyl]-10,20-bis(3,5-ditert-butylphenyl)porphyrin-22,24-diid-5-yl]-3-(2-methoxypropanoylamino)phenyl]-2-methoxypropanamide;cobalt(2+);bis(cobalt(3+));sulfane?
N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis[3,5-bis(2,4,6-trimethylphenyl)phenyl]-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis(3,5-ditert-butylphenyl)-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis(2-methoxypropanoylamino)phenyl]-10,20-bis(3,5-ditert-butylphenyl)porphyrin-22,24-diid-5-yl]-3-(2-methoxypropanoylamino)phenyl]-2-methoxypropanamide;cobalt(2+);bis(cobalt(3+));sulfane has a molecular weight of 4504.84 g/mol, XLogP of 55.11, 44 rotatable bonds, 12 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis[3,5-bis(2,4,6-trimethylphenyl)phenyl]-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-10,20-bis(3,5-ditert-butylphenyl)-1H-porphyrin-21,22,24-triid-5-yl]-3-[(2,2-dimethylcyclopropanecarbonyl)amino]phenyl]-2,2-dimethylcyclopropane-1-carboxamide;N-[2-[15-[2,6-bis(2-methoxypropanoylamino)phenyl]-10,20-bis(3,5-ditert-butylphenyl)porphyrin-22,24-diid-5-yl]-3-(2-methoxypropanoylamino)phenyl]-2-methoxypropanamide;cobalt(2+);bis(cobalt(3+));sulfane is sourced from PubChem (CID 158345258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).