[2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride

C128H122ClF10N19O24 — CID 157215042

IUPAC[2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride
SMILESCc1c(C(=O)C(N)=O)c2c(OC(C(N)=O)C(C)C)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(C(N)=O)C(F)(F)F)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(C(N)=O)[N+](C)(C)C)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(F)(C(N)=O)C(F)(F)F)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(F)(F)C(N)=O)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(F)C(N)=O)cccc2n1Cc1ccccc1.[Cl-]
InChIInChI=1S/C23H26N4O4.C23H25N3O4.C21H17F4N3O4.C21H18F3N3O4.C20H17F2N3O4.C20H18FN3O4.ClH/c1-14-18(20(28)21(24)29)19-16(26(14)13-15-9-6-5-7-10-15)11-8-12-17(19)31-23(22(25)30)27(2,3)4;1-13(2)21(23(25)29)30-17-11-7-10-16-19(17)18(20(27)22(24)28)14(3)26(16)12-15-8-5-4-6-9-15;1-11-15(17(29)18(26)30)16-13(28(11)10-12-6-3-2-4-7-12)8-5-9-14(16)32-20(22,19(27)31)21(23,24)25;1-11-15(17(28)19(25)29)16-13(27(11)10-12-6-3-2-4-7-12)8-5-9-14(16)31-18(20(26)30)21(22,23)24;1-11-15(17(26)18(23)27)16-13(25(11)10-12-6-3-2-4-7-12)8-5-9-14(16)29-20(21,22)19(24)28;1-11-15(17(25)19(22)26)16-13(24(11)10-12-6-3-2-4-7-12)8-5-9-14(16)28-18(21)20(23)27;/h5-12,23H,13H2,1-4H3,(H3-,24,25,29,30);4-11,13,21H,12H2,1-3H3,(H2,24,28)(H2,25,29);2-9H,10H2,1H3,(H2,26,30)(H2,27,31);2-9,18H,10H2,1H3,(H2,25,29)(H2,26,30);2-9H,10H2,1H3,(H2,23,27)(H2,24,28);2-9,18H,10H2,1H3,(H2,22,26)(H2,23,27);1H
InChIKeyCWYRISFPFRXXPA-UHFFFAOYSA-N
MW2535.93 g/mol
LogP10.29
Rot. Bonds44

About [2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride

[2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride (PubChem CID 157215042) has the molecular formula C128H122ClF10N19O24 and a molecular weight of 2535.93 g/mol. Its IUPAC name is [2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride.

Molecular Properties

Compound Name[2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride
PubChem CID157215042
Molecular FormulaC128H122ClF10N19O24
Molecular Weight2535.93 g/mol
Exact Mass2533.84
IUPAC Name[2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride
SMILESCc1c(C(=O)C(N)=O)c2c(OC(C(N)=O)C(C)C)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(C(N)=O)C(F)(F)F)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(C(N)=O)[N+](C)(C)C)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(F)(C(N)=O)C(F)(F)F)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(F)(F)C(N)=O)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(F)C(N)=O)cccc2n1Cc1ccccc1.[Cl-]
InChIInChI=1S/C23H26N4O4.C23H25N3O4.C21H17F4N3O4.C21H18F3N3O4.C20H17F2N3O4.C20H18FN3O4.ClH/c1-14-18(20(28)21(24)29)19-16(26(14)13-15-9-6-5-7-10-15)11-8-12-17(19)31-23(22(25)30)27(2,3)4;1-13(2)21(23(25)29)30-17-11-7-10-16-19(17)18(20(27)22(24)28)14(3)26(16)12-15-8-5-4-6-9-15;1-11-15(17(29)18(26)30)16-13(28(11)10-12-6-3-2-4-7-12)8-5-9-14(16)32-20(22,19(27)31)21(23,24)25;1-11-15(17(28)19(25)29)16-13(27(11)10-12-6-3-2-4-7-12)8-5-9-14(16)31-18(20(26)30)21(22,23)24;1-11-15(17(26)18(23)27)16-13(25(11)10-12-6-3-2-4-7-12)8-5-9-14(16)29-20(21,22)19(24)28;1-11-15(17(25)19(22)26)16-13(24(11)10-12-6-3-2-4-7-12)8-5-9-14(16)28-18(21)20(23)27;/h5-12,23H,13H2,1-4H3,(H3-,24,25,29,30);4-11,13,21H,12H2,1-3H3,(H2,24,28)(H2,25,29);2-9H,10H2,1H3,(H2,26,30)(H2,27,31);2-9,18H,10H2,1H3,(H2,25,29)(H2,26,30);2-9H,10H2,1H3,(H2,23,27)(H2,24,28);2-9,18H,10H2,1H3,(H2,22,26)(H2,23,27);1H
InChIKeyCWYRISFPFRXXPA-UHFFFAOYSA-N
XLogP10.29
TPSA704.46 Ų
H-Bond Donors12
H-Bond Acceptors30
Rotatable Bonds44
Heavy Atoms182
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002535.93
LogP ≤ 510.29
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Analyze [2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride with MolForge

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Related Compounds

2-(1-Benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide
CID 16657051
2-(1-Benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide
CID 16657121
2-(1-Benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide
CID 16657183
1-Benzyl-2-methylindol-4-ol;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-bromo-2,3,3-trifluoropropanoic acid;methyl 2-(1-benzyl-2-methylindol-4-yl)oxy-3-bromo-2,3,3-trifluoropropanoate;methyl 2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-bromo-2,3,3-trifluoropropanoate;methyl 2-bromo-2,3,3,3-tetrafluoropropanoate
CID 157688697
[2-Amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-4-methylpentanoic acid;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride
CID 157844275
2-[1-benzyl-4-[2-(methanesulfonamido)-2-oxoethoxy]-2-methylindol-3-yl]-2-oxoacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoro-N-methylsulfonylacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-methylpropanoic acid;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxypropanoic acid;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide
CID 158365382
[2-Amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride
CID 158564831
1-Benzyl-2-methylindol-4-ol;methyl 2-(1-benzyl-2-methylindol-4-yl)oxy-3-bromo-2,3,3-trifluoropropanoate;methyl 2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-bromo-2,3,3-trifluoropropanoate;methyl 2-bromo-2,3,3,3-tetrafluoropropanoate
CID 160182308
[4-(2,2-dimethylpropyl)-2,2-di(propan-2-yl)pyrrolidin-1-yl]-(4-methoxy-1H-indol-2-yl)methanone;[2,2-di(propan-2-yl)-4-(trifluoromethoxy)pyrrolidin-1-yl]-(4-methoxy-1H-indol-2-yl)methanone;[4-ethoxy-2,2-di(propan-2-yl)pyrrolidin-1-yl]-(4-methoxy-1H-indol-2-yl)methanone;[4-ethyl-2,2-di(propan-2-yl)pyrrolidin-1-yl]-(4-methoxy-1H-indol-2-yl)methanone;methane;[4-methoxy-2,2-di(propan-2-yl)pyrrolidin-1-yl]-(4-methoxy-1H-indol-2-yl)methanone;(4-methoxy-1H-indol-2-yl)-[2,2,4-tri(propan-2-yl)pyrrolidin-1-yl]methanone
CID 162117395
[4-cyclohexyl-2,2-di(propan-2-yl)pyrrolidin-1-yl]-(4-methoxy-1H-indol-2-yl)methanone;[2,2-di(propan-2-yl)-4-pyridin-3-ylpyrrolidin-1-yl]-(4-methoxy-1H-indol-2-yl)methanone;[2,2-di(propan-2-yl)-4-pyridin-4-ylpyrrolidin-1-yl]-(4-methoxy-1H-indol-2-yl)methanone;[2,2-di(propan-2-yl)-4-(trifluoromethoxy)pyrrolidin-1-yl]-(4-methoxy-1H-indol-2-yl)methanone;(4-methoxy-1H-indol-2-yl)-[4-[(2-methylpropan-2-yl)oxy]-2,2-di(propan-2-yl)pyrrolidin-1-yl]methanone;(4-methoxy-1H-indol-2-yl)-[4-phenyl-2,2-di(propan-2-yl)pyrrolidin-1-yl]methanone
CID 163545827
N-[3-[12-[2-[9-[4-methyl-5-[4-(9-phenylcarbazol-3-yl)-N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino]cyclohexa-1,5-dien-1-yl]-[1]benzofuro[3,2-a]carbazol-12-yl]ethyl]-[1]benzofuro[3,2-a]carbazol-9-yl]phenyl]-N-[4-(1,2,2-trifluoroethenoxy)phenyl]dibenzofuran-2-amine
CID 163606190
(3S,3aS,6aR)-N-[4-(benzylamino)-3,4-dioxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl]-2-(4-methoxy-1H-indole-2-carbonyl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(7S)-N-[4-(benzylamino)-3,4-dioxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl]-6-(1H-indole-2-carbonyl)-6-azaspiro[2.5]octane-7-carboxamide;(2S)-N-[4-(benzylamino)-3,4-dioxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl]-1-(1H-indole-2-carbonyl)-4,4-dimethylpyrrolidine-2-carboxamide;(2S,4R)-N-[4-(benzylamino)-3,4-dioxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl]-1-(1H-indole-2-carbonyl)-4-methoxypyrrolidine-2-carboxamide;(2S,4R)-N-[4-(benzylamino)-3,4-dioxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl]-1-(1H-indole-2-carbonyl)-4-[(2-methylpropan-2-yl)oxy]pyrrolidine-2-carboxamide;(2S,4R)-N-[4-(benzylamino)-3,4-dioxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl]-1-(1H-indole-2-carbonyl)-4-(trifluoromethyl)pyrrolidine-2-carboxamide
CID 163841593

Frequently Asked Questions

What is the IUPAC name of [2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride?
The IUPAC name of [2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride (CID 157215042) is [2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride.
What is the SMILES notation for [2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride?
The canonical SMILES for [2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride is Cc1c(C(=O)C(N)=O)c2c(OC(C(N)=O)C(C)C)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(C(N)=O)C(F)(F)F)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(C(N)=O)[N+](C)(C)C)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(F)(C(N)=O)C(F)(F)F)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(F)(F)C(N)=O)cccc2n1Cc1ccccc1.Cc1c(C(=O)C(N)=O)c2c(OC(F)C(N)=O)cccc2n1Cc1ccccc1.[Cl-].
What is the InChIKey of [2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride?
The InChIKey is CWYRISFPFRXXPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O4.C23H25N3O4.C21H17F4N3O4.C21H18F3N3O4.C20H17F2N3O4.C20H18FN3O4.ClH/c1-14-18(20(28)21(24)29)19-16(26(14)13-15-9-6-5-7-10-15)11-8-12-17(19)31-23(22(25)30)27(2,3)4;1-13(2)21(23(25)29)30-17-11-7-10-16-19(17)18(20(27)22(24)28)14(3)26(16)12-15-8-5-4-6-9-15;1-11-15(17(29)18(26)30)16-13(28(11)10-12-6-3-2-4-7-12)8-5-9-14(16)32-20(22,19(27)31)21(23,24)25;1-11-15(17(28)19(25)29)16-13(27(11)10-12-6-3-2-4-7-12)8-5-9-14(16)31-18(20(26)30)21(22,23)24;1-11-15(17(26)18(23)27)16-13(25(11)10-12-6-3-2-4-7-12)8-5-9-14(16)29-20(21,22)19(24)28;1-11-15(17(25)19(22)26)16-13(24(11)10-12-6-3-2-4-7-12)8-5-9-14(16)28-18(21)20(23)27;/h5-12,23H,13H2,1-4H3,(H3-,24,25,29,30);4-11,13,21H,12H2,1-3H3,(H2,24,28)(H2,25,29);2-9H,10H2,1H3,(H2,26,30)(H2,27,31);2-9,18H,10H2,1H3,(H2,25,29)(H2,26,30);2-9H,10H2,1H3,(H2,23,27)(H2,24,28);2-9,18H,10H2,1H3,(H2,22,26)(H2,23,27);1H.
What are the key properties of [2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride?
[2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride has a molecular weight of 2535.93 g/mol, XLogP of 10.29, 44 rotatable bonds, 12 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for [2-amino-1-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-oxoethyl]-trimethylazanium;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,2-difluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2-fluoroacetamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3-methylbutanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-2,3,3,3-tetrafluoropropanamide;2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxy-3,3,3-trifluoropropanamide;chloride is sourced from PubChem (CID 157215042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).