2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane

C94H86F6N24O17S6 — CID 159454929

IUPAC2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane
SMILESC.CC(C)(C)OC(=O)Nc1nc2c(C(=O)O)cc(-c3cccc(NC(=O)[C@@H]4C[C@@H](F)CN4C(=O)Cn4nc(C(N)=O)c5ccccc54)c3F)cc2[nH]1.COC(=O)c1cc(-c2cccc(NC(=O)[C@@H]3C[C@@H](F)CN3C(=O)Cn3nc(C(N)=O)c4ccccc43)c2F)cc2[nH]c(N)nc12.NC(=O)c1nn(CC(=O)N2C[C@H](F)C[C@H]2C(=O)Nc2cccc(-c3cc(C(=O)O)c4nc(N)[nH]c4c3)c2F)c2ccccc12.S=S=S=S=S=S
InChIInChI=1S/C34H32F2N8O7.C30H26F2N8O5.C29H24F2N8O5.CH4.S6/c1-34(2,3)51-33(50)41-32-39-22-12-16(11-20(31(48)49)27(22)40-32)18-8-6-9-21(26(18)36)38-30(47)24-13-17(35)14-43(24)25(45)15-44-23-10-5-4-7-19(23)28(42-44)29(37)46;1-45-29(44)18-9-14(10-20-25(18)37-30(34)36-20)16-6-4-7-19(24(16)32)35-28(43)22-11-15(31)12-39(22)23(41)13-40-21-8-3-2-5-17(21)26(38-40)27(33)42;30-14-10-21(38(11-14)22(40)12-39-20-7-2-1-4-16(20)25(37-39)26(32)41)27(42)34-18-6-3-5-15(23(18)31)13-8-17(28(43)44)24-19(9-13)35-29(33)36-24;;1-3-5-6-4-2/h4-12,17,24H,13-15H2,1-3H3,(H2,37,46)(H,38,47)(H,48,49)(H2,39,40,41,50);2-10,15,22H,11-13H2,1H3,(H2,33,42)(H,35,43)(H3,34,36,37);1-9,14,21H,10-12H2,(H2,32,41)(H,34,42)(H,43,44)(H3,33,35,36);1H4;/t17-,24+;15-,22+;14-,21+;;/m111../s1
InChIKeyLTVPASBJPIBZNK-ZKJFGDFJSA-N
MW2130.26 g/mol
LogP10.50
Rot. Bonds22

About 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane

2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane (PubChem CID 159454929) has the molecular formula C94H86F6N24O17S6 and a molecular weight of 2130.26 g/mol. Its IUPAC name is 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane.

Molecular Properties

Compound Name2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane
PubChem CID159454929
Molecular FormulaC94H86F6N24O17S6
Molecular Weight2130.26 g/mol
Exact Mass2128.48
IUPAC Name2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane
SMILESC.CC(C)(C)OC(=O)Nc1nc2c(C(=O)O)cc(-c3cccc(NC(=O)[C@@H]4C[C@@H](F)CN4C(=O)Cn4nc(C(N)=O)c5ccccc54)c3F)cc2[nH]1.COC(=O)c1cc(-c2cccc(NC(=O)[C@@H]3C[C@@H](F)CN3C(=O)Cn3nc(C(N)=O)c4ccccc43)c2F)cc2[nH]c(N)nc12.NC(=O)c1nn(CC(=O)N2C[C@H](F)C[C@H]2C(=O)Nc2cccc(-c3cc(C(=O)O)c4nc(N)[nH]c4c3)c2F)c2ccccc12.S=S=S=S=S=S
InChIInChI=1S/C34H32F2N8O7.C30H26F2N8O5.C29H24F2N8O5.CH4.S6/c1-34(2,3)51-33(50)41-32-39-22-12-16(11-20(31(48)49)27(22)40-32)18-8-6-9-21(26(18)36)38-30(47)24-13-17(35)14-43(24)25(45)15-44-23-10-5-4-7-19(23)28(42-44)29(37)46;1-45-29(44)18-9-14(10-20-25(18)37-30(34)36-20)16-6-4-7-19(24(16)32)35-28(43)22-11-15(31)12-39(22)23(41)13-40-21-8-3-2-5-17(21)26(38-40)27(33)42;30-14-10-21(38(11-14)22(40)12-39-20-7-2-1-4-16(20)25(37-39)26(32)41)27(42)34-18-6-3-5-15(23(18)31)13-8-17(28(43)44)24-19(9-13)35-29(33)36-24;;1-3-5-6-4-2/h4-12,17,24H,13-15H2,1-3H3,(H2,37,46)(H,38,47)(H,48,49)(H2,39,40,41,50);2-10,15,22H,11-13H2,1H3,(H2,33,42)(H,35,43)(H3,34,36,37);1-9,14,21H,10-12H2,(H2,32,41)(H,34,42)(H,43,44)(H3,33,35,36);1H4;/t17-,24+;15-,22+;14-,21+;;/m111../s1
InChIKeyLTVPASBJPIBZNK-ZKJFGDFJSA-N
XLogP10.50
TPSA608.27 Ų
H-Bond Donors14
H-Bond Acceptors28
Rotatable Bonds22
Heavy Atoms147
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002130.26
LogP ≤ 510.50
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1028

Analyze 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane with MolForge

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Related Compounds

US10807952, Cmp No. 76
CID 126622663
US10807952, Cmp No. 80
CID 135221700
US10807952, Cmp No. 77
CID 126622636
US10807952, Cmp No. 75
CID 126622683
6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid
CID 135226090
methyl 2-amino-6-[3-[[(2S,4R)-1-[2-[3-[amino(hydroxy)methyl]indazol-1-yl]acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate
CID 155214597
2-amino-6-[3-[[(2S,4R)-1-[2-[3-[amino(hydroxy)methyl]indazol-1-yl]acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid
CID 155214601
N-[2-amino-4-(trifluoromethyl)phenyl]-2-[4-[2-(3,5-dimethylpyrazol-1-yl)acetyl]piperazin-1-yl]benzamide;tert-butyl 4-[2-[[2-amino-4-(trifluoromethyl)phenyl]carbamoyl]phenyl]piperazine-1-carboxylate;2-(3,5-dimethylpyrazol-1-yl)acetic acid;2-(3,5-dimethylpyrazol-1-yl)-1-[4-[2-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl]piperazin-1-yl]ethanone;2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]benzoic acid;4-(trifluoromethyl)benzene-1,2-diamine
CID 159631751
2-amino-6-[3-[[(2S)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid
CID 166883682
methyl 6-[3-[[(1R,5S)-2-[2-(3-carbamoylindazol-1-yl)acetyl]-5-fluorocyclohexanecarbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylate
CID 166883732
6-[3-[2-[(2S,4R)-1-[2-(3-acetylindazol-1-yl)acetyl]-4-fluoropyrrolidin-2-yl]-2-oxoethyl]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid
CID 159998358
2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;hydrochloride
CID 126622635

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane?
The IUPAC name of 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane (CID 159454929) is 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane.
What is the SMILES notation for 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane?
The canonical SMILES for 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane is C.CC(C)(C)OC(=O)Nc1nc2c(C(=O)O)cc(-c3cccc(NC(=O)[C@@H]4C[C@@H](F)CN4C(=O)Cn4nc(C(N)=O)c5ccccc54)c3F)cc2[nH]1.COC(=O)c1cc(-c2cccc(NC(=O)[C@@H]3C[C@@H](F)CN3C(=O)Cn3nc(C(N)=O)c4ccccc43)c2F)cc2[nH]c(N)nc12.NC(=O)c1nn(CC(=O)N2C[C@H](F)C[C@H]2C(=O)Nc2cccc(-c3cc(C(=O)O)c4nc(N)[nH]c4c3)c2F)c2ccccc12.S=S=S=S=S=S.
What is the InChIKey of 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane?
The InChIKey is LTVPASBJPIBZNK-ZKJFGDFJSA-N. The full InChI is InChI=1S/C34H32F2N8O7.C30H26F2N8O5.C29H24F2N8O5.CH4.S6/c1-34(2,3)51-33(50)41-32-39-22-12-16(11-20(31(48)49)27(22)40-32)18-8-6-9-21(26(18)36)38-30(47)24-13-17(35)14-43(24)25(45)15-44-23-10-5-4-7-19(23)28(42-44)29(37)46;1-45-29(44)18-9-14(10-20-25(18)37-30(34)36-20)16-6-4-7-19(24(16)32)35-28(43)22-11-15(31)12-39(22)23(41)13-40-21-8-3-2-5-17(21)26(38-40)27(33)42;30-14-10-21(38(11-14)22(40)12-39-20-7-2-1-4-16(20)25(37-39)26(32)41)27(42)34-18-6-3-5-15(23(18)31)13-8-17(28(43)44)24-19(9-13)35-29(33)36-24;;1-3-5-6-4-2/h4-12,17,24H,13-15H2,1-3H3,(H2,37,46)(H,38,47)(H,48,49)(H2,39,40,41,50);2-10,15,22H,11-13H2,1H3,(H2,33,42)(H,35,43)(H3,34,36,37);1-9,14,21H,10-12H2,(H2,32,41)(H,34,42)(H,43,44)(H3,33,35,36);1H4;/t17-,24+;15-,22+;14-,21+;;/m111../s1.
What are the key properties of 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane?
2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane has a molecular weight of 2130.26 g/mol, XLogP of 10.50, 22 rotatable bonds, 14 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylic acid;6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-benzimidazole-4-carboxylic acid;methane;methyl 2-amino-6-[3-[[(2S,4R)-1-[2-(3-carbamoylindazol-1-yl)acetyl]-4-fluoropyrrolidine-2-carbonyl]amino]-2-fluorophenyl]-1H-benzimidazole-4-carboxylate;sulfanylidene-[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane is sourced from PubChem (CID 159454929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).