4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde

C218H161N25O18 — CID 159060721

IUPAC4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde
SMILESC.C.COc1ccc(C=O)cc1.N#Cc1ccc(C(c2ccc[nH]2)c2ccc[nH]2)cc1.O=Cc1ccc(OCCCN2C(=O)c3ccccc3C2=O)cc1.[C-]#[N+]c1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4ccc([nH]4)c(-c4ccc(C#N)cc4)c4nc(c(-c5ccc(OC)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1.[C-]#[N+]c1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4ccc([nH]4)c(-c4ccc(C#N)cc4)c4nc(c(-c5ccc(OCCCN6C(=O)c7ccccc7C6=O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1.[C-]#[N+]c1ccc(-c2c3nc(c(-c4ccc(OCCCN5C(=O)c6ccccc6C5=O)cc4)c4ccc([nH]4)c(-c4ccc(C#N)cc4)c4nc(c(-c5ccc(OCCCN6C(=O)c7ccccc7C6=O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1
InChIInChI=1S/C68H46N8O6.C58H39N7O4.C48H32N6O2.C18H15NO4.C16H13N3.C8H8O2.2CH4/c1-70-46-22-16-43(17-23-46)62-55-30-34-59(73-55)63(44-18-24-47(25-19-44)81-38-6-36-75-65(77)49-8-2-3-9-50(49)66(75)78)57-32-28-53(71-57)61(42-14-12-41(40-69)13-15-42)54-29-33-58(72-54)64(60-35-31-56(62)74-60)45-20-26-48(27-21-45)82-39-7-37-76-67(79)51-10-4-5-11-52(51)68(76)80;1-60-40-18-12-37(13-19-40)54-47-26-30-50(63-47)55(38-14-20-41(68-2)21-15-38)49-28-24-45(61-49)53(36-10-8-35(34-59)9-11-36)46-25-29-51(62-46)56(52-31-27-48(54)64-52)39-16-22-42(23-17-39)69-33-5-32-65-57(66)43-6-3-4-7-44(43)58(65)67;1-50-34-14-8-31(9-15-34)46-39-22-26-43(53-39)47(32-10-16-35(55-2)17-11-32)41-24-20-37(51-41)45(30-6-4-29(28-49)5-7-30)38-21-25-42(52-38)48(44-27-23-40(46)54-44)33-12-18-36(56-3)19-13-33;20-12-13-6-8-14(9-7-13)23-11-3-10-19-17(21)15-4-1-2-5-16(15)18(19)22;17-11-12-5-7-13(8-6-12)16(14-3-1-9-18-14)15-4-2-10-19-15;1-10-8-4-2-7(6-9)3-5-8;;/h2-5,8-35,71,74H,6-7,36-39H2;3-4,6-31,61,64H,5,32-33H2,2H3;4-27,51,54H,2-3H3;1-2,4-9,12H,3,10-11H2;1-10,16,18-19H;2-6H,1H3;2*1H4/b61-53-,61-54-,62-55-,62-56-,63-57-,63-59-,64-58-,64-60-;53-45-,53-46-,54-47-,54-48-,55-49-,55-50-,56-51-,56-52-;45-37-,45-38-,46-39-,46-40-,47-41-,47-43-,48-42-,48-44-;;;;;
InChIKeyJYKWURAFJSRYPL-CZBSLOPCSA-N
MW3418.84 g/mol
LogP47.20
Rot. Bonds41

About 4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde

4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde (PubChem CID 159060721) has the molecular formula C218H161N25O18 and a molecular weight of 3418.84 g/mol. Its IUPAC name is 4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde.

Molecular Properties

Compound Name4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde
PubChem CID159060721
Molecular FormulaC218H161N25O18
Molecular Weight3418.84 g/mol
Exact Mass3416.25
IUPAC Name4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde
SMILESC.C.COc1ccc(C=O)cc1.N#Cc1ccc(C(c2ccc[nH]2)c2ccc[nH]2)cc1.O=Cc1ccc(OCCCN2C(=O)c3ccccc3C2=O)cc1.[C-]#[N+]c1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4ccc([nH]4)c(-c4ccc(C#N)cc4)c4nc(c(-c5ccc(OC)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1.[C-]#[N+]c1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4ccc([nH]4)c(-c4ccc(C#N)cc4)c4nc(c(-c5ccc(OCCCN6C(=O)c7ccccc7C6=O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1.[C-]#[N+]c1ccc(-c2c3nc(c(-c4ccc(OCCCN5C(=O)c6ccccc6C5=O)cc4)c4ccc([nH]4)c(-c4ccc(C#N)cc4)c4nc(c(-c5ccc(OCCCN6C(=O)c7ccccc7C6=O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1
InChIInChI=1S/C68H46N8O6.C58H39N7O4.C48H32N6O2.C18H15NO4.C16H13N3.C8H8O2.2CH4/c1-70-46-22-16-43(17-23-46)62-55-30-34-59(73-55)63(44-18-24-47(25-19-44)81-38-6-36-75-65(77)49-8-2-3-9-50(49)66(75)78)57-32-28-53(71-57)61(42-14-12-41(40-69)13-15-42)54-29-33-58(72-54)64(60-35-31-56(62)74-60)45-20-26-48(27-21-45)82-39-7-37-76-67(79)51-10-4-5-11-52(51)68(76)80;1-60-40-18-12-37(13-19-40)54-47-26-30-50(63-47)55(38-14-20-41(68-2)21-15-38)49-28-24-45(61-49)53(36-10-8-35(34-59)9-11-36)46-25-29-51(62-46)56(52-31-27-48(54)64-52)39-16-22-42(23-17-39)69-33-5-32-65-57(66)43-6-3-4-7-44(43)58(65)67;1-50-34-14-8-31(9-15-34)46-39-22-26-43(53-39)47(32-10-16-35(55-2)17-11-32)41-24-20-37(51-41)45(30-6-4-29(28-49)5-7-30)38-21-25-42(52-38)48(44-27-23-40(46)54-44)33-12-18-36(56-3)19-13-33;20-12-13-6-8-14(9-7-13)23-11-3-10-19-17(21)15-4-1-2-5-16(15)18(19)22;17-11-12-5-7-13(8-6-12)16(14-3-1-9-18-14)15-4-2-10-19-15;1-10-8-4-2-7(6-9)3-5-8;;/h2-5,8-35,71,74H,6-7,36-39H2;3-4,6-31,61,64H,5,32-33H2,2H3;4-27,51,54H,2-3H3;1-2,4-9,12H,3,10-11H2;1-10,16,18-19H;2-6H,1H3;2*1H4/b61-53-,61-54-,62-55-,62-56-,63-57-,63-59-,64-58-,64-60-;53-45-,53-46-,54-47-,54-48-,55-49-,55-50-,56-51-,56-52-;45-37-,45-38-,46-39-,46-40-,47-41-,47-43-,48-42-,48-44-;;;;;
InChIKeyJYKWURAFJSRYPL-CZBSLOPCSA-N
XLogP47.20
TPSA569.40 Ų
H-Bond Donors8
H-Bond Acceptors28
Rotatable Bonds41
Heavy Atoms261
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003418.84
LogP ≤ 547.20
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1028

Analyze 4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde with MolForge

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Related Compounds

5,10,15,20-Tetrakis-[3-(3-phthalimidopropyloxy)-phenyl]-porphyrin
CID 16178995
4-[10,20-Bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile
CID 58012913
4-[15-(4-Cyanophenyl)-10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-21,23-dihydroporphyrin-5-yl]benzonitrile
CID 88562688
4-[10-[4-[3-(1,3-Dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,22,23,24-tetrahydroporphyrin-5-yl]benzonitrile
CID 123366072
4-[4-[15-[4-[3-(1,3-Dioxoisoindol-2-yl)propoxy]phenyl]-10,20-dipyridin-4-yl-21,22,23,24-tetrahydroporphyrin-5-yl]phenoxy]butanenitrile
CID 123741959
2-[3-[4-[15-(4-Methoxyphenyl)-10,20-dipyridin-4-yl-21,22,23,24-tetrahydroporphyrin-5-yl]phenoxy]propyl]isoindole-1,3-dione
CID 123910317
4-[10,20-Bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,22,23,24-tetrahydroporphyrin-5-yl]benzonitrile
CID 123950468
2-[3-[4-[15-(4-Methoxyphenyl)-10,20-dipyridin-4-yl-21,23-dihydroporphyrin-5-yl]phenoxy]propyl]isoindole-1,3-dione
CID 136199117
4-[10-[4-[3-(1,3-Dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile
CID 136199119
N-[3-[4-[10,20-bis(4-cyanophenyl)-15-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]phenoxy]propyl]-2-(1H-pyrrol-3-yl)acetamide
CID 136199120
4-[4-[15-[4-[3-(1,3-Dioxoisoindol-2-yl)propoxy]phenyl]-10,20-dipyridin-4-yl-21,23-dihydroporphyrin-5-yl]phenoxy]butanenitrile
CID 136199125
2-[3-[4-(10,15,20-Tripyridin-4-yl-21,23-dihydroporphyrin-5-yl)phenoxy]propyl]isoindole-1,3-dione
CID 136199126

Frequently Asked Questions

What is the IUPAC name of 4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde?
The IUPAC name of 4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde (CID 159060721) is 4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde.
What is the SMILES notation for 4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde?
The canonical SMILES for 4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde is C.C.COc1ccc(C=O)cc1.N#Cc1ccc(C(c2ccc[nH]2)c2ccc[nH]2)cc1.O=Cc1ccc(OCCCN2C(=O)c3ccccc3C2=O)cc1.[C-]#[N+]c1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4ccc([nH]4)c(-c4ccc(C#N)cc4)c4nc(c(-c5ccc(OC)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1.[C-]#[N+]c1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4ccc([nH]4)c(-c4ccc(C#N)cc4)c4nc(c(-c5ccc(OCCCN6C(=O)c7ccccc7C6=O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1.[C-]#[N+]c1ccc(-c2c3nc(c(-c4ccc(OCCCN5C(=O)c6ccccc6C5=O)cc4)c4ccc([nH]4)c(-c4ccc(C#N)cc4)c4nc(c(-c5ccc(OCCCN6C(=O)c7ccccc7C6=O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1.
What is the InChIKey of 4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde?
The InChIKey is JYKWURAFJSRYPL-CZBSLOPCSA-N. The full InChI is InChI=1S/C68H46N8O6.C58H39N7O4.C48H32N6O2.C18H15NO4.C16H13N3.C8H8O2.2CH4/c1-70-46-22-16-43(17-23-46)62-55-30-34-59(73-55)63(44-18-24-47(25-19-44)81-38-6-36-75-65(77)49-8-2-3-9-50(49)66(75)78)57-32-28-53(71-57)61(42-14-12-41(40-69)13-15-42)54-29-33-58(72-54)64(60-35-31-56(62)74-60)45-20-26-48(27-21-45)82-39-7-37-76-67(79)51-10-4-5-11-52(51)68(76)80;1-60-40-18-12-37(13-19-40)54-47-26-30-50(63-47)55(38-14-20-41(68-2)21-15-38)49-28-24-45(61-49)53(36-10-8-35(34-59)9-11-36)46-25-29-51(62-46)56(52-31-27-48(54)64-52)39-16-22-42(23-17-39)69-33-5-32-65-57(66)43-6-3-4-7-44(43)58(65)67;1-50-34-14-8-31(9-15-34)46-39-22-26-43(53-39)47(32-10-16-35(55-2)17-11-32)41-24-20-37(51-41)45(30-6-4-29(28-49)5-7-30)38-21-25-42(52-38)48(44-27-23-40(46)54-44)33-12-18-36(56-3)19-13-33;20-12-13-6-8-14(9-7-13)23-11-3-10-19-17(21)15-4-1-2-5-16(15)18(19)22;17-11-12-5-7-13(8-6-12)16(14-3-1-9-18-14)15-4-2-10-19-15;1-10-8-4-2-7(6-9)3-5-8;;/h2-5,8-35,71,74H,6-7,36-39H2;3-4,6-31,61,64H,5,32-33H2,2H3;4-27,51,54H,2-3H3;1-2,4-9,12H,3,10-11H2;1-10,16,18-19H;2-6H,1H3;2*1H4/b61-53-,61-54-,62-55-,62-56-,63-57-,63-59-,64-58-,64-60-;53-45-,53-46-,54-47-,54-48-,55-49-,55-50-,56-51-,56-52-;45-37-,45-38-,46-39-,46-40-,47-41-,47-43-,48-42-,48-44-;;;;;.
What are the key properties of 4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde?
4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde has a molecular weight of 3418.84 g/mol, XLogP of 47.20, 41 rotatable bonds, 8 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[10,20-bis[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[bis(1H-pyrrol-2-yl)methyl]benzonitrile;4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde;4-[10-[4-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]-15-(4-isocyanophenyl)-20-(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;4-[15-(4-isocyanophenyl)-10,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]benzonitrile;methane;4-methoxybenzaldehyde is sourced from PubChem (CID 159060721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).