2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide

C114H127BrFN39O16 — CID 158791436

IUPAC2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide
SMILESC=CCN.C=CC[n+]1c(N)[nH]c2cc(C(N)=O)ccc21.C=CCn1c(NC(=O)c2cc(C)nn2CC)nc2cc(C(N)=O)ccc21.CCn1nc(C)cc1C(=O)Nc1nc2cc(C(N)=O)ccc2n1C/C=C/Cn1c(NC(=O)c2cc(C)nn2CC)nc2cc(C(N)=O)ccc21.CCn1nc(C)cc1C(=O)Nc1nc2cc(C(N)=O)ccc2n1C/C=C/Cn1c(NC(=O)c2cc(C)nn2CC)nc2cc(C(N)=O)ccc21.CCn1nc(C)cc1C(=O)O.NC(=O)c1ccc(F)c([N+](=O)[O-])c1.[Br-]
InChIInChI=1S/2C34H36N12O4.C18H20N6O2.C11H12N4O.C7H5FN2O3.C7H10N2O2.C3H7N.BrH/c2*1-5-45-27(15-19(3)41-45)31(49)39-33-37-23-17-21(29(35)47)9-11-25(23)43(33)13-7-8-14-44-26-12-10-22(30(36)48)18-24(26)38-34(44)40-32(50)28-16-20(4)42-46(28)6-2;1-4-8-23-14-7-6-12(16(19)25)10-13(14)20-18(23)21-17(26)15-9-11(3)22-24(15)5-2;1-2-5-15-9-4-3-7(10(12)16)6-8(9)14-11(15)13;8-5-2-1-4(7(9)11)3-6(5)10(12)13;1-3-9-6(7(10)11)4-5(2)8-9;1-2-3-4;/h2*7-12,15-18H,5-6,13-14H2,1-4H3,(H2,35,47)(H2,36,48)(H,37,39,49)(H,38,40,50);4,6-7,9-10H,1,5,8H2,2-3H3,(H2,19,25)(H,20,21,26);2-4,6H,1,5H2,(H4,12,13,14,16);1-3H,(H2,9,11);4H,3H2,1-2H3,(H,10,11);2H,1,3-4H2;1H/b2*8-7+;;;;;;
InChIKeyNFGXSMXAGNPVCL-LIHYUARASA-N
MW2398.43 g/mol
LogP8.09
Rot. Bonds38

About 2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide

2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide (PubChem CID 158791436) has the molecular formula C114H127BrFN39O16 and a molecular weight of 2398.43 g/mol. Its IUPAC name is 2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide.

Molecular Properties

Compound Name2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide
PubChem CID158791436
Molecular FormulaC114H127BrFN39O16
Molecular Weight2398.43 g/mol
Exact Mass2395.95
IUPAC Name2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide
SMILESC=CCN.C=CC[n+]1c(N)[nH]c2cc(C(N)=O)ccc21.C=CCn1c(NC(=O)c2cc(C)nn2CC)nc2cc(C(N)=O)ccc21.CCn1nc(C)cc1C(=O)Nc1nc2cc(C(N)=O)ccc2n1C/C=C/Cn1c(NC(=O)c2cc(C)nn2CC)nc2cc(C(N)=O)ccc21.CCn1nc(C)cc1C(=O)Nc1nc2cc(C(N)=O)ccc2n1C/C=C/Cn1c(NC(=O)c2cc(C)nn2CC)nc2cc(C(N)=O)ccc21.CCn1nc(C)cc1C(=O)O.NC(=O)c1ccc(F)c([N+](=O)[O-])c1.[Br-]
InChIInChI=1S/2C34H36N12O4.C18H20N6O2.C11H12N4O.C7H5FN2O3.C7H10N2O2.C3H7N.BrH/c2*1-5-45-27(15-19(3)41-45)31(49)39-33-37-23-17-21(29(35)47)9-11-25(23)43(33)13-7-8-14-44-26-12-10-22(30(36)48)18-24(26)38-34(44)40-32(50)28-16-20(4)42-46(28)6-2;1-4-8-23-14-7-6-12(16(19)25)10-13(14)20-18(23)21-17(26)15-9-11(3)22-24(15)5-2;1-2-5-15-9-4-3-7(10(12)16)6-8(9)14-11(15)13;8-5-2-1-4(7(9)11)3-6(5)10(12)13;1-3-9-6(7(10)11)4-5(2)8-9;1-2-3-4;/h2*7-12,15-18H,5-6,13-14H2,1-4H3,(H2,35,47)(H2,36,48)(H,37,39,49)(H,38,40,50);4,6-7,9-10H,1,5,8H2,2-3H3,(H2,19,25)(H,20,21,26);2-4,6H,1,5H2,(H4,12,13,14,16);1-3H,(H2,9,11);4H,3H2,1-2H3,(H,10,11);2H,1,3-4H2;1H/b2*8-7+;;;;;;
InChIKeyNFGXSMXAGNPVCL-LIHYUARASA-N
XLogP8.09
TPSA795.30 Ų
H-Bond Donors16
H-Bond Acceptors39
Rotatable Bonds38
Heavy Atoms171
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002398.43
LogP ≤ 58.09
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1039

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide with MolForge

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Related Compounds

1-[4-[5-Carboxy-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]butyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxylic acid
CID 165146904
2-Amino-1-[4-(2-amino-5-carbamoylbenzimidazol-1-yl)-2,2,3,3-tetrafluorobutyl]benzimidazole-5-carboxamide;1-[4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]-2,2,3,3-tetrafluorobutyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;methane
CID 157746565
3-Amino-4-[[4-(2-amino-4-carbamoylanilino)-2,2,3,3-tetrafluorobutyl]amino]benzamide;2-amino-1-[4-(2-amino-5-carbamoylbenzimidazol-1-yl)-2,2,3,3-tetrafluorobutyl]benzimidazole-5-carboxamide;bis(1-[4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]-2,2,3,3-tetrafluorobutyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);4-[[4-(4-carbamoyl-2-nitroanilino)-2,2,3,3-tetrafluorobutyl]amino]-3-nitrobenzamide;carbononitridic bromide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;2,2,3,3-tetrafluorobutane-1,4-diamine
CID 158202333
3-Amino-4-[[4-(2-amino-4-carbamoylanilino)-2,2,3,3-tetrafluorobutyl]amino]benzamide;2-amino-1-[4-(2-amino-5-carbamoylbenzimidazol-1-yl)-2,2,3,3-tetrafluorobutyl]benzimidazole-5-carboxamide;1-[4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]-2,2,3,3-tetrafluorobutyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide;4-[[4-(4-carbamoyl-2-nitroanilino)-2,2,3,3-tetrafluorobutyl]amino]-3-nitrobenzamide;carbononitridic bromide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;methane;2,2,3,3-tetrafluorobutane-1,4-diamine
CID 160503951
3-Amino-4-[[4-(2-amino-4-carbamoylanilino)-2,2,3,3-tetrafluorobutyl]amino]benzamide;1-[4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]-2,2,3,3-tetrafluorobutyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide;4-[[4-(4-carbamoyl-2-nitroanilino)-2,2,3,3-tetrafluorobutyl]amino]-3-nitrobenzamide;carbononitridic bromide;4-fluoro-3-nitrobenzamide;2,2,3,3-tetrafluorobutane-1,4-diamine
CID 160635605
2-Amino-1-[4-(2-amino-5-carbamoylbenzimidazol-1-yl)-2,2,3,3-tetrafluorobutyl]benzimidazole-5-carboxamide;1-[4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]-2,2,3,3-tetrafluorobutyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid
CID 160687587
1-[4-[5-Carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]butyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxylic acid
CID 131997706
1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxylic acid
CID 131999940
5-Ethyl-19-hydroxy-7,16,32-trimethyl-3-oxo-2,5,6,14,15,20,22,29,32,35,42-undecazaheptacyclo[33.7.0.04,8.014,18.021,29.023,28.036,41]dotetraconta-1(42),4(8),6,15,17,21,23(28),24,26,36(41),37,39-dodecaene-25,39-dicarboxamide
CID 137305587
5-Ethyl-19-hydroxy-7,16-dimethyl-3-oxo-24-(5-oxoimidazolidin-1-yl)-2,5,6,14,15,20,22,29,34,41-decazaheptacyclo[32.7.0.04,8.014,18.021,29.023,28.035,40]hentetraconta-1(41),4(8),6,15,17,21,23(28),24,26,35(40),36,38-dodecaene-38-carboxamide
CID 145380519
1-[4-[5-Carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]butyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-2,3-dihydrobenzimidazole-5-carboxylic acid
CID 146319429
1-[4-[5-Carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]butyl]-2-[(2-ethyl-4,5-dimethylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxylic acid
CID 152562312

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide?
The IUPAC name of 2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide (CID 158791436) is 2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide.
What is the SMILES notation for 2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide?
The canonical SMILES for 2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide is C=CCN.C=CC[n+]1c(N)[nH]c2cc(C(N)=O)ccc21.C=CCn1c(NC(=O)c2cc(C)nn2CC)nc2cc(C(N)=O)ccc21.CCn1nc(C)cc1C(=O)Nc1nc2cc(C(N)=O)ccc2n1C/C=C/Cn1c(NC(=O)c2cc(C)nn2CC)nc2cc(C(N)=O)ccc21.CCn1nc(C)cc1C(=O)Nc1nc2cc(C(N)=O)ccc2n1C/C=C/Cn1c(NC(=O)c2cc(C)nn2CC)nc2cc(C(N)=O)ccc21.CCn1nc(C)cc1C(=O)O.NC(=O)c1ccc(F)c([N+](=O)[O-])c1.[Br-].
What is the InChIKey of 2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide?
The InChIKey is NFGXSMXAGNPVCL-LIHYUARASA-N. The full InChI is InChI=1S/2C34H36N12O4.C18H20N6O2.C11H12N4O.C7H5FN2O3.C7H10N2O2.C3H7N.BrH/c2*1-5-45-27(15-19(3)41-45)31(49)39-33-37-23-17-21(29(35)47)9-11-25(23)43(33)13-7-8-14-44-26-12-10-22(30(36)48)18-24(26)38-34(44)40-32(50)28-16-20(4)42-46(28)6-2;1-4-8-23-14-7-6-12(16(19)25)10-13(14)20-18(23)21-17(26)15-9-11(3)22-24(15)5-2;1-2-5-15-9-4-3-7(10(12)16)6-8(9)14-11(15)13;8-5-2-1-4(7(9)11)3-6(5)10(12)13;1-3-9-6(7(10)11)4-5(2)8-9;1-2-3-4;/h2*7-12,15-18H,5-6,13-14H2,1-4H3,(H2,35,47)(H2,36,48)(H,37,39,49)(H,38,40,50);4,6-7,9-10H,1,5,8H2,2-3H3,(H2,19,25)(H,20,21,26);2-4,6H,1,5H2,(H4,12,13,14,16);1-3H,(H2,9,11);4H,3H2,1-2H3,(H,10,11);2H,1,3-4H2;1H/b2*8-7+;;;;;;.
What are the key properties of 2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide?
2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide has a molecular weight of 2398.43 g/mol, XLogP of 8.09, 38 rotatable bonds, 16 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-prop-2-enyl-3H-benzimidazol-1-ium-5-carboxamide;bis(1-[(E)-4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]but-2-enyl]-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazole-5-carboxamide);2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-prop-2-enylbenzimidazole-5-carboxamide;2-ethyl-5-methylpyrazole-3-carboxylic acid;4-fluoro-3-nitrobenzamide;prop-2-en-1-amine;bromide is sourced from PubChem (CID 158791436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).