N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid

C210H298N10O40S5 — CID 160904232

IUPACN-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid
SMILESCOc1ccc(C(SCCCCCCCCCCC(=O)NCCCCCN)(c2ccccc2)c2ccccc2)cc1.COc1ccc(C(SCCCCCCCCCCC(=O)NCCCN)(c2ccccc2)c2ccccc2)cc1.COc1ccc(C(SCCCCCCCCCCC(=O)NCCCNC(=O)COCCOCCOCC(=O)O)(c2ccccc2)c2ccccc2)cc1.COc1ccc(C(SCCCCCCCCCCC(=O)NCCOCCOCCN)(c2ccccc2)c2ccccc2)cc1.COc1ccc(C(SCCCCCCCCCCC(=O)NCCOCCOCCNC(=O)COCCOCCOCC(=O)O)(c2ccccc2)c2ccccc2)cc1.O=C(O)COCCOCCOCC(=O)O.O=C(O)COCCOCCOCC(=O)O
InChIInChI=1S/C45H64N2O10S.C42H58N2O8S.C37H52N2O4S.C36H50N2O2S.C34H46N2O2S.2C8H14O7/c1-52-41-23-21-40(22-24-41)45(38-16-10-8-11-17-38,39-18-12-9-13-19-39)58-35-15-7-5-3-2-4-6-14-20-42(48)46-25-27-53-29-30-54-28-26-47-43(49)36-56-33-31-55-32-34-57-37-44(50)51;1-49-38-24-22-37(23-25-38)42(35-17-10-8-11-18-35,36-19-12-9-13-20-36)53-32-15-7-5-3-2-4-6-14-21-39(45)43-26-16-27-44-40(46)33-51-30-28-50-29-31-52-34-41(47)48;1-41-35-23-21-34(22-24-35)37(32-16-10-8-11-17-32,33-18-12-9-13-19-33)44-31-15-7-5-3-2-4-6-14-20-36(40)39-26-28-43-30-29-42-27-25-38;1-40-34-26-24-33(25-27-34)36(31-19-11-8-12-20-31,32-21-13-9-14-22-32)41-30-18-7-5-3-2-4-6-15-23-35(39)38-29-17-10-16-28-37;1-38-32-24-22-31(23-25-32)34(29-17-10-8-11-18-29,30-19-12-9-13-20-30)39-28-15-7-5-3-2-4-6-14-21-33(37)36-27-16-26-35;2*9-7(10)5-14-3-1-13-2-4-15-6-8(11)12/h8-13,16-19,21-24H,2-7,14-15,20,25-37H2,1H3,(H,46,48)(H,47,49)(H,50,51);8-13,17-20,22-25H,2-7,14-16,21,26-34H2,1H3,(H,43,45)(H,44,46)(H,47,48);8-13,16-19,21-24H,2-7,14-15,20,25-31,38H2,1H3,(H,39,40);8-9,11-14,19-22,24-27H,2-7,10,15-18,23,28-30,37H2,1H3,(H,38,39);8-13,17-20,22-25H,2-7,14-16,21,26-28,35H2,1H3,(H,36,37);2*1-6H2,(H,9,10)(H,11,12)
InChIKeySPXISVZTYSRTIO-UHFFFAOYSA-N
MW3763.06 g/mol
LogP35.54
Rot. Bonds149

About N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid

N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid (PubChem CID 160904232) has the molecular formula C210H298N10O40S5 and a molecular weight of 3763.06 g/mol. Its IUPAC name is N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid.

Molecular Properties

Compound NameN-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid
PubChem CID160904232
Molecular FormulaC210H298N10O40S5
Molecular Weight3763.06 g/mol
Exact Mass3760.02
IUPAC NameN-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid
SMILESCOc1ccc(C(SCCCCCCCCCCC(=O)NCCCCCN)(c2ccccc2)c2ccccc2)cc1.COc1ccc(C(SCCCCCCCCCCC(=O)NCCCN)(c2ccccc2)c2ccccc2)cc1.COc1ccc(C(SCCCCCCCCCCC(=O)NCCCNC(=O)COCCOCCOCC(=O)O)(c2ccccc2)c2ccccc2)cc1.COc1ccc(C(SCCCCCCCCCCC(=O)NCCOCCOCCN)(c2ccccc2)c2ccccc2)cc1.COc1ccc(C(SCCCCCCCCCCC(=O)NCCOCCOCCNC(=O)COCCOCCOCC(=O)O)(c2ccccc2)c2ccccc2)cc1.O=C(O)COCCOCCOCC(=O)O.O=C(O)COCCOCCOCC(=O)O
InChIInChI=1S/C45H64N2O10S.C42H58N2O8S.C37H52N2O4S.C36H50N2O2S.C34H46N2O2S.2C8H14O7/c1-52-41-23-21-40(22-24-41)45(38-16-10-8-11-17-38,39-18-12-9-13-19-39)58-35-15-7-5-3-2-4-6-14-20-42(48)46-25-27-53-29-30-54-28-26-47-43(49)36-56-33-31-55-32-34-57-37-44(50)51;1-49-38-24-22-37(23-25-38)42(35-17-10-8-11-18-35,36-19-12-9-13-20-36)53-32-15-7-5-3-2-4-6-14-21-39(45)43-26-16-27-44-40(46)33-51-30-28-50-29-31-52-34-41(47)48;1-41-35-23-21-34(22-24-35)37(32-16-10-8-11-17-32,33-18-12-9-13-19-33)44-31-15-7-5-3-2-4-6-14-20-36(40)39-26-28-43-30-29-42-27-25-38;1-40-34-26-24-33(25-27-34)36(31-19-11-8-12-20-31,32-21-13-9-14-22-32)41-30-18-7-5-3-2-4-6-15-23-35(39)38-29-17-10-16-28-37;1-38-32-24-22-31(23-25-32)34(29-17-10-8-11-18-29,30-19-12-9-13-20-30)39-28-15-7-5-3-2-4-6-14-21-33(37)36-27-16-26-35;2*9-7(10)5-14-3-1-13-2-4-15-6-8(11)12/h8-13,16-19,21-24H,2-7,14-15,20,25-37H2,1H3,(H,46,48)(H,47,49)(H,50,51);8-13,17-20,22-25H,2-7,14-16,21,26-34H2,1H3,(H,43,45)(H,44,46)(H,47,48);8-13,16-19,21-24H,2-7,14-15,20,25-31,38H2,1H3,(H,39,40);8-9,11-14,19-22,24-27H,2-7,10,15-18,23,28-30,37H2,1H3,(H,38,39);8-13,17-20,22-25H,2-7,14-16,21,26-28,35H2,1H3,(H,36,37);2*1-6H2,(H,9,10)(H,11,12)
InChIKeySPXISVZTYSRTIO-UHFFFAOYSA-N
XLogP35.54
TPSA699.39 Ų
H-Bond Donors16
H-Bond Acceptors42
Rotatable Bonds149
Heavy Atoms265
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003763.06
LogP ≤ 535.54
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1042

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid with MolForge

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

Launch Full Analysis

Related Compounds

(2S)-2-[[(2R)-3-[2-[2-[2-[(2R)-3-[[(1S)-1-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]amino]-3-oxo-2-[(2-phenoxyacetyl)amino]propyl]sulfanylethoxy]ethoxy]ethylsulfanyl]-2-[(2-phenoxyacetyl)amino]propanoyl]amino]-3-phenyl-propanoic acid
CID 44563792
3-[4-[2-[3-Benzylsulfanylpropyl(2-phenylethylcarbamoyl)amino]ethoxy]phenyl]-2-ethoxypropanoic acid
CID 22233891
2-[2-[2-[2-[5-[11-[(4-Methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]pentylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid
CID 60069389
N-[2-(2-aminoethoxy)ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide
CID 60069390
2-[2-[2-[2-[3-[11-[(4-Methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid
CID 60069391
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide
CID 60069395
2-[2-[2-[2-[2-[2-[2-[11-[(4-Methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid
CID 60069396
2-[2-[2-[2-[[11-[(4-Methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]methylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid
CID 60069399
N-[[[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetyl]amino]methyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide
CID 60069400
4-[4-[[3-[2-[2-[2-[[2-[2-[2-(9H-fluoren-9-ylmethoxy)-2-oxoethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]ethylamino]-3-oxopropyl]sulfanyl-diphenylmethyl]phenoxy]butanoic acid
CID 60084246
(6R,9S,12R,15S)-6-(2,3-dihydrothiophen-2-ylmethyl)-12-[(4-methoxyphenyl)methyl]-4,7,10,13-tetraoxo-9-[(4-phenylphenyl)methyl]-2-oxa-5,8,11,14-tetrazabicyclo[15.2.2]henicosa-1(19),17,20-triene-15-carboxylic acid
CID 70884603
(2R)-2-[[(6S,9R,12S,15S)-12-benzyl-6-(2,3-dihydrothiophen-2-ylmethyl)-4,7,10,13-tetraoxo-9-[(4-phenylphenyl)methyl]-2-oxa-5,8,11,14-tetrazabicyclo[15.2.2]henicosa-1(19),17,20-triene-15-carbonyl]amino]-3-phenylpropanoic acid
CID 70884724

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid?
The IUPAC name of N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid (CID 160904232) is N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid.
What is the SMILES notation for N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid?
The canonical SMILES for N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid is COc1ccc(C(SCCCCCCCCCCC(=O)NCCCCCN)(c2ccccc2)c2ccccc2)cc1.COc1ccc(C(SCCCCCCCCCCC(=O)NCCCN)(c2ccccc2)c2ccccc2)cc1.COc1ccc(C(SCCCCCCCCCCC(=O)NCCCNC(=O)COCCOCCOCC(=O)O)(c2ccccc2)c2ccccc2)cc1.COc1ccc(C(SCCCCCCCCCCC(=O)NCCOCCOCCN)(c2ccccc2)c2ccccc2)cc1.COc1ccc(C(SCCCCCCCCCCC(=O)NCCOCCOCCNC(=O)COCCOCCOCC(=O)O)(c2ccccc2)c2ccccc2)cc1.O=C(O)COCCOCCOCC(=O)O.O=C(O)COCCOCCOCC(=O)O.
What is the InChIKey of N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid?
The InChIKey is SPXISVZTYSRTIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H64N2O10S.C42H58N2O8S.C37H52N2O4S.C36H50N2O2S.C34H46N2O2S.2C8H14O7/c1-52-41-23-21-40(22-24-41)45(38-16-10-8-11-17-38,39-18-12-9-13-19-39)58-35-15-7-5-3-2-4-6-14-20-42(48)46-25-27-53-29-30-54-28-26-47-43(49)36-56-33-31-55-32-34-57-37-44(50)51;1-49-38-24-22-37(23-25-38)42(35-17-10-8-11-18-35,36-19-12-9-13-20-36)53-32-15-7-5-3-2-4-6-14-21-39(45)43-26-16-27-44-40(46)33-51-30-28-50-29-31-52-34-41(47)48;1-41-35-23-21-34(22-24-35)37(32-16-10-8-11-17-32,33-18-12-9-13-19-33)44-31-15-7-5-3-2-4-6-14-20-36(40)39-26-28-43-30-29-42-27-25-38;1-40-34-26-24-33(25-27-34)36(31-19-11-8-12-20-31,32-21-13-9-14-22-32)41-30-18-7-5-3-2-4-6-15-23-35(39)38-29-17-10-16-28-37;1-38-32-24-22-31(23-25-32)34(29-17-10-8-11-18-29,30-19-12-9-13-20-30)39-28-15-7-5-3-2-4-6-14-21-33(37)36-27-16-26-35;2*9-7(10)5-14-3-1-13-2-4-15-6-8(11)12/h8-13,16-19,21-24H,2-7,14-15,20,25-37H2,1H3,(H,46,48)(H,47,49)(H,50,51);8-13,17-20,22-25H,2-7,14-16,21,26-34H2,1H3,(H,43,45)(H,44,46)(H,47,48);8-13,16-19,21-24H,2-7,14-15,20,25-31,38H2,1H3,(H,39,40);8-9,11-14,19-22,24-27H,2-7,10,15-18,23,28-30,37H2,1H3,(H,38,39);8-13,17-20,22-25H,2-7,14-16,21,26-28,35H2,1H3,(H,36,37);2*1-6H2,(H,9,10)(H,11,12).
What are the key properties of N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid?
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid has a molecular weight of 3763.06 g/mol, XLogP of 35.54, 149 rotatable bonds, 16 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(5-aminopentyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;N-(3-aminopropyl)-11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanamide;bis(2-[2-[2-(carboxymethoxy)ethoxy]ethoxy]acetic acid);2-[2-[2-[2-[2-[2-[2-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid;2-[2-[2-[2-[3-[11-[(4-methoxyphenyl)-diphenylmethyl]sulfanylundecanoylamino]propylamino]-2-oxoethoxy]ethoxy]ethoxy]acetic acid is sourced from PubChem (CID 160904232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).