2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate

C94H96ClN21O22 — CID 160846334

IUPAC2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate
SMILESCCOC(=O)c1ccc(Cl)c([N+](=O)[O-])c1.CCOC(=O)c1ccc(NC)c(N)c1.CCOC(=O)c1ccc(NC)c([N+](=O)[O-])c1.CCOC(=O)c1ccc2c(c1)nc(N)n2C.CCOC(=O)c1ccc2c(c1)nc(Nc1nc3ccccc3o1)n2C.Cn1c(Nc2nc3ccccc3o2)nc2cc(C(=O)NCCOCCO)ccc21.Cn1c(Nc2nc3ccccc3o2)nc2cc(C(=O)O)ccc21
InChIInChI=1S/C20H21N5O4.C18H16N4O3.C16H12N4O3.C11H13N3O2.C10H12N2O4.C10H14N2O2.C9H8ClNO4/c1-25-16-7-6-13(18(27)21-8-10-28-11-9-26)12-15(16)22-19(25)24-20-23-14-4-2-3-5-17(14)29-20;1-3-24-16(23)11-8-9-14-13(10-11)19-17(22(14)2)21-18-20-12-6-4-5-7-15(12)25-18;1-20-12-7-6-9(14(21)22)8-11(12)17-15(20)19-16-18-10-4-2-3-5-13(10)23-16;1-3-16-10(15)7-4-5-9-8(6-7)13-11(12)14(9)2;1-3-16-10(13)7-4-5-8(11-2)9(6-7)12(14)15;1-3-14-10(13)7-4-5-9(12-2)8(11)6-7;1-2-15-9(12)6-3-4-7(10)8(5-6)11(13)14/h2-7,12,26H,8-11H2,1H3,(H,21,27)(H,22,23,24);4-10H,3H2,1-2H3,(H,19,20,21);2-8H,1H3,(H,21,22)(H,17,18,19);4-6H,3H2,1-2H3,(H2,12,13);4-6,11H,3H2,1-2H3;4-6,12H,3,11H2,1-2H3;3-5H,2H2,1H3
InChIKeySIROJWVWMNVVAC-UHFFFAOYSA-N
MW1907.38 g/mol
LogP16.05
Rot. Bonds27

About 2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate

2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate (PubChem CID 160846334) has the molecular formula C94H96ClN21O22 and a molecular weight of 1907.38 g/mol. Its IUPAC name is 2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate.

Molecular Properties

Compound Name2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate
PubChem CID160846334
Molecular FormulaC94H96ClN21O22
Molecular Weight1907.38 g/mol
Exact Mass1905.67
IUPAC Name2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate
SMILESCCOC(=O)c1ccc(Cl)c([N+](=O)[O-])c1.CCOC(=O)c1ccc(NC)c(N)c1.CCOC(=O)c1ccc(NC)c([N+](=O)[O-])c1.CCOC(=O)c1ccc2c(c1)nc(N)n2C.CCOC(=O)c1ccc2c(c1)nc(Nc1nc3ccccc3o1)n2C.Cn1c(Nc2nc3ccccc3o2)nc2cc(C(=O)NCCOCCO)ccc21.Cn1c(Nc2nc3ccccc3o2)nc2cc(C(=O)O)ccc21
InChIInChI=1S/C20H21N5O4.C18H16N4O3.C16H12N4O3.C11H13N3O2.C10H12N2O4.C10H14N2O2.C9H8ClNO4/c1-25-16-7-6-13(18(27)21-8-10-28-11-9-26)12-15(16)22-19(25)24-20-23-14-4-2-3-5-17(14)29-20;1-3-24-16(23)11-8-9-14-13(10-11)19-17(22(14)2)21-18-20-12-6-4-5-7-15(12)25-18;1-20-12-7-6-9(14(21)22)8-11(12)17-15(20)19-16-18-10-4-2-3-5-13(10)23-16;1-3-16-10(15)7-4-5-9-8(6-7)13-11(12)14(9)2;1-3-16-10(13)7-4-5-8(11-2)9(6-7)12(14)15;1-3-14-10(13)7-4-5-9(12-2)8(11)6-7;1-2-15-9(12)6-3-4-7(10)8(5-6)11(13)14/h2-7,12,26H,8-11H2,1H3,(H,21,27)(H,22,23,24);4-10H,3H2,1-2H3,(H,19,20,21);2-8H,1H3,(H,21,22)(H,17,18,19);4-6H,3H2,1-2H3,(H2,12,13);4-6,11H,3H2,1-2H3;4-6,12H,3,11H2,1-2H3;3-5H,2H2,1H3
InChIKeySIROJWVWMNVVAC-UHFFFAOYSA-N
XLogP16.05
TPSA575.20 Ų
H-Bond Donors10
H-Bond Acceptors39
Rotatable Bonds27
Heavy Atoms138
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001907.38
LogP ≤ 516.05
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1039

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2-aminooxyethyl)-2-(dimethylamino)acetamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;6-[2-[2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazol-5-yl]-2-oxoethoxy]hexan-3-one;tert-butyl N-[2-(1,3-dioxoisoindol-2-yl)oxyethyl]carbamate;2-(dimethylamino)-N-[2-(1,3-dioxoisoindol-2-yl)oxyethyl]acetamide;N-[2-(1,3-dioxoisoindol-2-yl)oxyethyl]-2,2,2-trifluoroacetamide;2-hydroxyisoindole-1,3-dione
CID 158255471
N-[2-(2-hydroxyethoxy)ethyl]-1-methyl-2-[[6-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxamide;1-methyl-2-[[6-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxylic acid
CID 158287249
1-(2-Amino-1-ethylbenzimidazol-5-yl)ethanone;tris(carbon dioxide);1-chloro-4-ethyl-2-nitrobenzene;4-ethyl-2-nitro-1-propylbenzene;5-ethyl-2-propylaniline;1-ethyl-2-[[6-(trifluoromethoxy)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-ethyl-2-[[6-(trifluoromethoxy)-1,3-benzoxazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-ethyl-2-[[6-(trifluoromethoxy)-1,3-benzoxazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one
CID 158334668
2-amino-5-(trifluoromethyl)phenol;2-chloro-6-(trifluoromethyl)-1,3-benzoxazole;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 1-methyl-2-[[6-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxylate;N-(2-methoxyethyl)-1-methyl-2-[[6-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxamide;1-methyl-2-[[6-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxylic acid;2-nitro-5-(trifluoromethyl)phenol;6-(trifluoromethyl)-3H-1,3-benzoxazole-2-thione;3-(trifluoromethyl)phenol
CID 158925544
N-(2-hydroxyethyl)-1-methyl-2-[[6-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxamide;1-methyl-2-[[6-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxylic acid
CID 159168167
1-[2-amino-1-(2-methylsulfonylethyl)benzimidazol-5-yl]ethanone;tris(carbon dioxide);1-chloro-4-ethyl-2-nitrobenzene;4-ethyl-1-N-(2-methylsulfonylethyl)benzene-1,2-diamine;4-ethyl-N-(2-methylsulfonylethyl)-2-nitroaniline;1-(2-methylsulfonylethyl)-2-[[6-(trifluoromethoxy)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-(2-methylsulfonylethyl)-2-[[6-(trifluoromethoxy)-1,3-benzoxazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-(2-methylsulfonylethyl)-2-[[6-(trifluoromethoxy)-1,3-benzoxazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one
CID 159239758
2-amino-6-methylphenol;2-chloro-7-(trifluoromethyl)-1,3-benzoxazole;4-(2-hydroxyethoxy)-1-[1-methyl-2-[[7-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazol-5-yl]butan-1-one;2-methyl-6-nitrophenol;2-methylphenol;1-methyl-2-[[7-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[7-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazol-5-yl]ethanone;7-(trifluoromethyl)-3H-1,3-benzoxazole-2-thione
CID 159535376
2-amino-4-(trifluoromethyl)phenol;1-chloro-2-nitro-4-(trifluoromethyl)benzene;2-chloro-5-(trifluoromethyl)-1,3-benzoxazole;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 1-methyl-2-[[5-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxylate;N-[2-(2-hydroxyethoxy)ethyl]-1-methyl-2-[[5-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxamide;1-methyl-2-[[5-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxylic acid;2-nitro-4-(trifluoromethyl)phenol;5-(trifluoromethyl)-3H-1,3-benzoxazole-2-thione
CID 159569946
2-[2-(dimethylamino)ethoxy]isoindole-1,3-dione;O-[2-(dimethylamino)ethyl]hydroxylamine;2-hydroxyisoindole-1,3-dione;1-methyl-2-[[6-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]benzimidazol-5-yl]-2-propoxyethanone
CID 160561911
3-[(2-Amino-4-ethylanilino)methyl]oxetan-3-ol;1-[2-amino-1-[(3-hydroxyoxetan-3-yl)methyl]benzimidazol-5-yl]ethanone;3-(aminomethyl)oxetan-3-ol;pentakis(carbon dioxide);1-chloro-4-ethyl-2-nitrobenzene;3-[(4-ethyl-2-nitroanilino)methyl]oxetan-3-ol;3-[[5-ethyl-2-[[6-(trifluoromethoxy)-1,3-benzoxazol-2-yl]amino]benzimidazol-1-yl]methyl]oxetan-3-ol;1-[1-[(3-hydroxyoxetan-3-yl)methyl]-2-[[6-(trifluoromethoxy)-1,3-benzoxazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one;3-(nitromethyl)oxetan-3-ol;oxetan-3-one;3-[[2-[[6-(trifluoromethoxy)-1,3-benzoxazol-2-yl]amino]benzimidazol-1-yl]methyl]oxetan-3-ol
CID 161301624
1-[2-Amino-1-(oxolan-3-ylmethyl)benzimidazol-5-yl]ethanone;tris(carbon dioxide);1-chloro-4-ethyl-2-nitrobenzene;3-[2-(4-ethyl-2-nitrophenyl)ethyl]oxolane;5-ethyl-2-[2-(oxolan-3-yl)ethyl]aniline;1-(oxolan-3-ylmethyl)-2-[[6-(trifluoromethoxy)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-(oxolan-3-ylmethyl)-2-[[6-(trifluoromethoxy)-1,3-benzoxazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-(oxolan-3-ylmethyl)-2-[[6-(trifluoromethoxy)-1,3-benzoxazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one
CID 161340756
carbon dioxide;N-[1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]-6-(trifluoromethoxy)-1,3-benzoxazol-2-amine;ethyl 3-amino-4-[2-(dimethylamino)ethylamino]benzoate;ethyl 2-amino-1-[2-(dimethylamino)ethyl]benzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-[2-(dimethylamino)ethylamino]-3-nitrobenzoate;ethyl 1-[2-(dimethylamino)ethyl]-2-[[6-(trifluoromethoxy)-1,3-benzoxazol-2-yl]amino]benzimidazole-5-carboxylate
CID 162171888

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate?
The IUPAC name of 2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate (CID 160846334) is 2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate.
What is the SMILES notation for 2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate?
The canonical SMILES for 2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate is CCOC(=O)c1ccc(Cl)c([N+](=O)[O-])c1.CCOC(=O)c1ccc(NC)c(N)c1.CCOC(=O)c1ccc(NC)c([N+](=O)[O-])c1.CCOC(=O)c1ccc2c(c1)nc(N)n2C.CCOC(=O)c1ccc2c(c1)nc(Nc1nc3ccccc3o1)n2C.Cn1c(Nc2nc3ccccc3o2)nc2cc(C(=O)NCCOCCO)ccc21.Cn1c(Nc2nc3ccccc3o2)nc2cc(C(=O)O)ccc21.
What is the InChIKey of 2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate?
The InChIKey is SIROJWVWMNVVAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O4.C18H16N4O3.C16H12N4O3.C11H13N3O2.C10H12N2O4.C10H14N2O2.C9H8ClNO4/c1-25-16-7-6-13(18(27)21-8-10-28-11-9-26)12-15(16)22-19(25)24-20-23-14-4-2-3-5-17(14)29-20;1-3-24-16(23)11-8-9-14-13(10-11)19-17(22(14)2)21-18-20-12-6-4-5-7-15(12)25-18;1-20-12-7-6-9(14(21)22)8-11(12)17-15(20)19-16-18-10-4-2-3-5-13(10)23-16;1-3-16-10(15)7-4-5-9-8(6-7)13-11(12)14(9)2;1-3-16-10(13)7-4-5-8(11-2)9(6-7)12(14)15;1-3-14-10(13)7-4-5-9(12-2)8(11)6-7;1-2-15-9(12)6-3-4-7(10)8(5-6)11(13)14/h2-7,12,26H,8-11H2,1H3,(H,21,27)(H,22,23,24);4-10H,3H2,1-2H3,(H,19,20,21);2-8H,1H3,(H,21,22)(H,17,18,19);4-6H,3H2,1-2H3,(H2,12,13);4-6,11H,3H2,1-2H3;4-6,12H,3,11H2,1-2H3;3-5H,2H2,1H3.
What are the key properties of 2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate?
2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate has a molecular weight of 1907.38 g/mol, XLogP of 16.05, 27 rotatable bonds, 10 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-benzoxazol-2-ylamino)-N-[2-(2-hydroxyethoxy)ethyl]-1-methylbenzimidazole-5-carboxamide;2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylic acid;ethyl 3-amino-4-(methylamino)benzoate;ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 4-chloro-3-nitrobenzoate;ethyl 4-(methylamino)-3-nitrobenzoate is sourced from PubChem (CID 160846334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).