N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide

C175H181N21O38 — CID 158642231

IUPACN-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide
SMILESC=C1CCC(N2C(=O)c3cccc(OCCCCCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)N1.O=C1CCC(N2C(=O)c3cccc(OCCCCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)C1.O=C1CCC(N2C(=O)c3cccc(OCCOCCOCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)C1.O=C1CCC(N2C(=O)c3cccc(OCCOCCOCCOCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)C1.O=C1CCC(N2C(=O)c3cccc(OCCOCCOCCOCCOCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)C1
InChIInChI=1S/C38H42N4O10.C36H38N4O9.C34H35N5O5.C34H34N4O8.C33H32N4O6/c43-26-6-8-32(33(44)23-26)42-37(46)28-2-1-3-34(36(28)38(42)47)52-21-20-51-19-18-50-17-16-49-15-14-48-13-12-40-35(45)9-5-25-4-7-27-29-24-39-11-10-30(29)41-31(27)22-25;41-24-6-8-30(31(42)21-24)40-35(44)26-2-1-3-32(34(26)36(40)45)49-19-18-48-17-16-47-15-14-46-13-12-38-33(43)9-5-23-4-7-25-27-22-37-11-10-28(27)39-29(25)20-23;1-21-9-13-28(32(41)37-21)39-33(42)24-7-6-8-29(31(24)34(39)43)44-18-5-3-2-4-16-36-30(40)14-11-22-10-12-23-25-20-35-17-15-26(25)38-27(23)19-22;39-22-6-8-28(29(40)19-22)38-33(42)24-2-1-3-30(32(24)34(38)43)46-17-16-45-15-14-44-13-12-36-31(41)9-5-21-4-7-23-25-20-35-11-10-26(25)37-27(23)18-21;38-21-9-11-27(28(39)18-21)37-32(41)23-5-4-6-29(31(23)33(37)42)43-16-3-1-2-14-35-30(40)12-8-20-7-10-22-24-19-34-15-13-25(24)36-26(22)17-20/h1-4,7,10-11,22,24,32,41H,5-6,8-9,12-21,23H2,(H,40,45);1-4,7,10-11,20,22,30,39H,5-6,8-9,12-19,21H2,(H,38,43);6-8,10,12,15,17,19-20,28,38H,1-5,9,11,13-14,16,18H2,(H,36,40)(H,37,41);1-4,7,10-11,18,20,28,37H,5-6,8-9,12-17,19H2,(H,36,41);4-7,10,13,15,17,19,27,36H,1-3,8-9,11-12,14,16,18H2,(H,35,40)
InChIKeyIANNSELYHLWOTO-UHFFFAOYSA-N
MW3186.48 g/mol
LogP18.63
Rot. Bonds74

About N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide

N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide (PubChem CID 158642231) has the molecular formula C175H181N21O38 and a molecular weight of 3186.48 g/mol. Its IUPAC name is N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide.

Molecular Properties

Compound NameN-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide
PubChem CID158642231
Molecular FormulaC175H181N21O38
Molecular Weight3186.48 g/mol
Exact Mass3184.29
IUPAC NameN-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide
SMILESC=C1CCC(N2C(=O)c3cccc(OCCCCCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)N1.O=C1CCC(N2C(=O)c3cccc(OCCCCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)C1.O=C1CCC(N2C(=O)c3cccc(OCCOCCOCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)C1.O=C1CCC(N2C(=O)c3cccc(OCCOCCOCCOCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)C1.O=C1CCC(N2C(=O)c3cccc(OCCOCCOCCOCCOCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)C1
InChIInChI=1S/C38H42N4O10.C36H38N4O9.C34H35N5O5.C34H34N4O8.C33H32N4O6/c43-26-6-8-32(33(44)23-26)42-37(46)28-2-1-3-34(36(28)38(42)47)52-21-20-51-19-18-50-17-16-49-15-14-48-13-12-40-35(45)9-5-25-4-7-27-29-24-39-11-10-30(29)41-31(27)22-25;41-24-6-8-30(31(42)21-24)40-35(44)26-2-1-3-32(34(26)36(40)45)49-19-18-48-17-16-47-15-14-46-13-12-38-33(43)9-5-23-4-7-25-27-22-37-11-10-28(27)39-29(25)20-23;1-21-9-13-28(32(41)37-21)39-33(42)24-7-6-8-29(31(24)34(39)43)44-18-5-3-2-4-16-36-30(40)14-11-22-10-12-23-25-20-35-17-15-26(25)38-27(23)19-22;39-22-6-8-28(29(40)19-22)38-33(42)24-2-1-3-30(32(24)34(38)43)46-17-16-45-15-14-44-13-12-36-31(41)9-5-21-4-7-23-25-20-35-11-10-26(25)37-27(23)18-21;38-21-9-11-27(28(39)18-21)37-32(41)23-5-4-6-29(31(23)33(37)42)43-16-3-1-2-14-35-30(40)12-8-20-7-10-22-24-19-34-15-13-25(24)36-26(22)17-20/h1-4,7,10-11,22,24,32,41H,5-6,8-9,12-21,23H2,(H,40,45);1-4,7,10-11,20,22,30,39H,5-6,8-9,12-19,21H2,(H,38,43);6-8,10,12,15,17,19-20,28,38H,1-5,9,11,13-14,16,18H2,(H,36,40)(H,37,41);1-4,7,10-11,18,20,28,37H,5-6,8-9,12-17,19H2,(H,36,41);4-7,10,13,15,17,19,27,36H,1-3,8-9,11-12,14,16,18H2,(H,35,40)
InChIKeyIANNSELYHLWOTO-UHFFFAOYSA-N
XLogP18.63
TPSA770.68 Ų
H-Bond Donors11
H-Bond Acceptors43
Rotatable Bonds74
Heavy Atoms234
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003186.48
LogP ≤ 518.63
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1043

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide?
The IUPAC name of N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide (CID 158642231) is N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide.
What is the SMILES notation for N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide?
The canonical SMILES for N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide is C=C1CCC(N2C(=O)c3cccc(OCCCCCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)N1.O=C1CCC(N2C(=O)c3cccc(OCCCCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)C1.O=C1CCC(N2C(=O)c3cccc(OCCOCCOCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)C1.O=C1CCC(N2C(=O)c3cccc(OCCOCCOCCOCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)C1.O=C1CCC(N2C(=O)c3cccc(OCCOCCOCCOCCOCCNC(=O)CCc4ccc5c(c4)[nH]c4ccncc45)c3C2=O)C(=O)C1.
What is the InChIKey of N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide?
The InChIKey is IANNSELYHLWOTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H42N4O10.C36H38N4O9.C34H35N5O5.C34H34N4O8.C33H32N4O6/c43-26-6-8-32(33(44)23-26)42-37(46)28-2-1-3-34(36(28)38(42)47)52-21-20-51-19-18-50-17-16-49-15-14-48-13-12-40-35(45)9-5-25-4-7-27-29-24-39-11-10-30(29)41-31(27)22-25;41-24-6-8-30(31(42)21-24)40-35(44)26-2-1-3-32(34(26)36(40)45)49-19-18-48-17-16-47-15-14-46-13-12-38-33(43)9-5-23-4-7-25-27-22-37-11-10-28(27)39-29(25)20-23;1-21-9-13-28(32(41)37-21)39-33(42)24-7-6-8-29(31(24)34(39)43)44-18-5-3-2-4-16-36-30(40)14-11-22-10-12-23-25-20-35-17-15-26(25)38-27(23)19-22;39-22-6-8-28(29(40)19-22)38-33(42)24-2-1-3-30(32(24)34(38)43)46-17-16-45-15-14-44-13-12-36-31(41)9-5-21-4-7-23-25-20-35-11-10-26(25)37-27(23)18-21;38-21-9-11-27(28(39)18-21)37-32(41)23-5-4-6-29(31(23)33(37)42)43-16-3-1-2-14-35-30(40)12-8-20-7-10-22-24-19-34-15-13-25(24)36-26(22)17-20/h1-4,7,10-11,22,24,32,41H,5-6,8-9,12-21,23H2,(H,40,45);1-4,7,10-11,20,22,30,39H,5-6,8-9,12-19,21H2,(H,38,43);6-8,10,12,15,17,19-20,28,38H,1-5,9,11,13-14,16,18H2,(H,36,40)(H,37,41);1-4,7,10-11,18,20,28,37H,5-6,8-9,12-17,19H2,(H,36,41);4-7,10,13,15,17,19,27,36H,1-3,8-9,11-12,14,16,18H2,(H,35,40).
What are the key properties of N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide?
N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide has a molecular weight of 3186.48 g/mol, XLogP of 18.63, 74 rotatable bonds, 11 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[2-[2-[2-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxyethoxy]ethoxy]ethyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[5-[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]oxypentyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide;N-[6-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexyl]-3-(5H-pyrido[4,3-b]indol-7-yl)propanamide is sourced from PubChem (CID 158642231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).