4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid

C84H76ClN25O15S6 — CID 161396258

IUPAC4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid
SMILESC.Cc1nc(N2CCCCC2)ncc1-c1scc(NC(=O)c2cnccn2)c1C(=O)O.Cc1nc(N2CCCCC2)ncc1-c1scc(NC(=O)c2cncnc2)c1C(=O)O.Cc1ncsc1C(=O)Nc1csc(-c2cnccn2)c1C(=O)O.Cn1ccc(C(=O)Nc2csc(-c3cnccn3)c2C(=O)O)c1Cl.Cn1cnc(C(=O)Nc2csc(-c3cnccn3)c2C(=O)O)c1
InChIInChI=1S/2C20H20N6O3S.C15H11ClN4O3S.C14H11N5O3S.C14H10N4O3S2.CH4/c1-12-13(9-23-20(24-12)26-7-3-2-4-8-26)17-16(19(28)29)15(11-30-17)25-18(27)14-10-21-5-6-22-14;1-12-14(9-23-20(24-12)26-5-3-2-4-6-26)17-16(19(28)29)15(10-30-17)25-18(27)13-7-21-11-22-8-13;1-20-5-2-8(13(20)16)14(21)19-10-7-24-12(11(10)15(22)23)9-6-17-3-4-18-9;1-19-5-9(17-7-19)13(20)18-10-6-23-12(11(10)14(21)22)8-4-15-2-3-16-8;1-7-11(23-6-17-7)13(19)18-9-5-22-12(10(9)14(20)21)8-4-15-2-3-16-8;/h5-6,9-11H,2-4,7-8H2,1H3,(H,25,27)(H,28,29);7-11H,2-6H2,1H3,(H,25,27)(H,28,29);2-7H,1H3,(H,19,21)(H,22,23);2-7H,1H3,(H,18,20)(H,21,22);2-6H,1H3,(H,18,19)(H,20,21);1H4
InChIKeyVTQGAZLTCFWCKV-UHFFFAOYSA-N
MW1903.55 g/mol
LogP15.08
Rot. Bonds22

About 4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid

4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid (PubChem CID 161396258) has the molecular formula C84H76ClN25O15S6 and a molecular weight of 1903.55 g/mol. Its IUPAC name is 4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid.

Molecular Properties

Compound Name4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid
PubChem CID161396258
Molecular FormulaC84H76ClN25O15S6
Molecular Weight1903.55 g/mol
Exact Mass1901.40
IUPAC Name4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid
SMILESC.Cc1nc(N2CCCCC2)ncc1-c1scc(NC(=O)c2cnccn2)c1C(=O)O.Cc1nc(N2CCCCC2)ncc1-c1scc(NC(=O)c2cncnc2)c1C(=O)O.Cc1ncsc1C(=O)Nc1csc(-c2cnccn2)c1C(=O)O.Cn1ccc(C(=O)Nc2csc(-c3cnccn3)c2C(=O)O)c1Cl.Cn1cnc(C(=O)Nc2csc(-c3cnccn3)c2C(=O)O)c1
InChIInChI=1S/2C20H20N6O3S.C15H11ClN4O3S.C14H11N5O3S.C14H10N4O3S2.CH4/c1-12-13(9-23-20(24-12)26-7-3-2-4-8-26)17-16(19(28)29)15(11-30-17)25-18(27)14-10-21-5-6-22-14;1-12-14(9-23-20(24-12)26-5-3-2-4-6-26)17-16(19(28)29)15(10-30-17)25-18(27)13-7-21-11-22-8-13;1-20-5-2-8(13(20)16)14(21)19-10-7-24-12(11(10)15(22)23)9-6-17-3-4-18-9;1-19-5-9(17-7-19)13(20)18-10-6-23-12(11(10)14(21)22)8-4-15-2-3-16-8;1-7-11(23-6-17-7)13(19)18-9-5-22-12(10(9)14(20)21)8-4-15-2-3-16-8;/h5-6,9-11H,2-4,7-8H2,1H3,(H,25,27)(H,28,29);7-11H,2-6H2,1H3,(H,25,27)(H,28,29);2-7H,1H3,(H,19,21)(H,22,23);2-7H,1H3,(H,18,20)(H,21,22);2-6H,1H3,(H,18,19)(H,20,21);1H4
InChIKeyVTQGAZLTCFWCKV-UHFFFAOYSA-N
XLogP15.08
TPSA554.58 Ų
H-Bond Donors10
H-Bond Acceptors36
Rotatable Bonds22
Heavy Atoms131
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001903.55
LogP ≤ 515.08
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1036

Analyze 4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid with MolForge

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Launch Full Analysis

Related Compounds

2-[(5-Chloro-1-methylpyrazole-4-carbonyl)amino]-4-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)thiophene-3-carboxylic acid;4-pyrazin-2-yl-2-(pyridine-4-carbonylamino)thiophene-3-carboxylic acid
CID 123546012
2-[(1-Methylimidazole-4-carbonyl)amino]-4-pyrazin-2-ylthiophene-3-carboxylic acid;4-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-2-[(4-methyl-1,2-thiazole-5-carbonyl)amino]thiophene-3-carboxylic acid
CID 123606555
2-[6-[5-[[4-Carboxy-5-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)thiophen-3-yl]carbamoyl]-4-methylthiadiazol-2-ium-2-yl]pyrazin-2-yl]-4-[(1-methylimidazole-4-carbonyl)amino]thiophene-3-carboxylic acid
CID 123753433
2-[(5-chloro-1-methylimidazole-4-carbonyl)amino]-4-pyrazin-2-ylthiophene-3-carboxylic acid;2-[(5-methyl-1H-imidazole-4-carbonyl)amino]-4-pyrazin-2-ylthiophene-3-carboxylic acid;4-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-2-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-2-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid
CID 157173489
Tert-butyl 4-[1-(4-chlorophenyl)pyrazol-4-yl]-2-(pyrazine-2-carbonylamino)thiophene-3-carboxylate;2-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-4-(2,5-dimethylpyrazol-3-yl)thiophene-3-carboxylic acid;4-[1-(4-chlorophenyl)pyrazol-4-yl]-2-[(1-methylimidazole-4-carbonyl)amino]thiophene-3-carboxylic acid;4-[1-(4-chlorophenyl)pyrazol-4-yl]-2-[(4-methyl-1,2-thiazole-5-carbonyl)amino]thiophene-3-carboxylic acid;4-[1-(4-chlorophenyl)pyrazol-4-yl]-2-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;4-[1-(4-chlorophenyl)pyrazol-4-yl]-2-(pyridine-3-carbonylamino)thiophene-3-carboxylic acid;4-(2,5-dimethylpyrazol-3-yl)-2-[(4-methyl-1,3-thiazole-5-carbonyl)amino]thiophene-3-carboxylic acid
CID 157442158
4-(6-Bromo-2-pyridinyl)-2-[3-(3-methylphenyl)propanoylamino]thiophene-3-carboxylic acid;4-(6-bromo-3-pyridinyl)-2-[3-(3-methylphenyl)propanoylamino]thiophene-3-carboxylic acid;4-(6-chloro-3-pyridinyl)-2-[(3-methylbenzoyl)amino]thiophene-3-carboxylic acid;4-(6-chloro-3-pyridinyl)-2-[3-(3-methylphenyl)propanoylamino]thiophene-3-carboxylic acid;4-(5-chloro-2-pyridinyl)-2-(3-phenylpropanoylamino)thiophene-3-carboxylic acid;2-[(3-methylbenzoyl)amino]-4-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)thiophene-3-carboxylic acid;2-[(3-methylbenzoyl)amino]-4-pyrazin-2-ylthiophene-3-carboxylic acid
CID 157887047
4-[(2-Chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-[(4-methyl-1,2-thiazole-5-carbonyl)amino]thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid
CID 158901888
4-(6-Bromo-2-pyridinyl)-2-[3-(3-methylphenyl)propanoylamino]thiophene-3-carboxylic acid;4-(6-bromo-3-pyridinyl)-2-[3-(3-methylphenyl)propanoylamino]thiophene-3-carboxylic acid;4-(6-chloro-3-pyridinyl)-2-[3-(3-methylphenyl)propanoylamino]thiophene-3-carboxylic acid;4-(5-chloro-2-pyridinyl)-2-(3-phenylpropanoylamino)thiophene-3-carboxylic acid;2-[(3-methylbenzoyl)amino]-4-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)thiophene-3-carboxylic acid;2-[(3-methylbenzoyl)amino]-4-pyrazin-2-ylthiophene-3-carboxylic acid
CID 160117615
2-[(2-Chloro-1-methylpyrrole-3-carbonyl)amino]-4-pyrazin-2-ylthiophene-3-carboxylic acid;2-[(1-methylimidazole-4-carbonyl)amino]-4-pyrazin-2-ylthiophene-3-carboxylic acid;4-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-2-[(4-methyl-1,2-thiazole-5-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-2-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-2-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;2-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-4-pyrazin-2-ylthiophene-3-carboxylic acid
CID 160385244
2-(6-Bromo-2-pyridinyl)-4-[3-(3-methylphenyl)propanoylamino]thiophene-3-carboxylic acid;2-(6-bromo-3-pyridinyl)-4-[3-(3-methylphenyl)propanoylamino]thiophene-3-carboxylic acid;2-(6-chloro-3-pyridinyl)-4-[(3-methylbenzoyl)amino]thiophene-3-carboxylic acid;2-(6-chloro-3-pyridinyl)-4-[3-(3-methylphenyl)propanoylamino]thiophene-3-carboxylic acid;2-(6-chloro-3-pyridinyl)-4-(3-phenylpropanoylamino)thiophene-3-carboxylic acid;4-[(3-methylbenzoyl)amino]-2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)thiophene-3-carboxylic acid;4-[(3-methylbenzoyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid
CID 160387613
2-(6-Bromo-2-pyridinyl)-4-[3-(3-methylphenyl)propanoylamino]thiophene-3-carboxylic acid;2-(6-bromo-3-pyridinyl)-4-[3-(3-methylphenyl)propanoylamino]thiophene-3-carboxylic acid;2-(6-chloro-3-pyridinyl)-4-[3-(3-methylphenyl)propanoylamino]thiophene-3-carboxylic acid;2-(6-chloro-3-pyridinyl)-4-(3-phenylpropanoylamino)thiophene-3-carboxylic acid;4-[(3-methylbenzoyl)amino]-2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)thiophene-3-carboxylic acid;4-[(3-methylbenzoyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid
CID 160641884
2-[(5-Chloro-1-methylpyrazole-4-carbonyl)amino]-4-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)thiophene-3-carboxylic acid;4-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-2-[(4-methyl-1,3-thiazole-5-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-2-(pyridine-3-carbonylamino)thiophene-3-carboxylic acid;4-pyrazin-2-yl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylic acid
CID 160969968

Frequently Asked Questions

What is the IUPAC name of 4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid?
The IUPAC name of 4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid (CID 161396258) is 4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid.
What is the SMILES notation for 4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid?
The canonical SMILES for 4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid is C.Cc1nc(N2CCCCC2)ncc1-c1scc(NC(=O)c2cnccn2)c1C(=O)O.Cc1nc(N2CCCCC2)ncc1-c1scc(NC(=O)c2cncnc2)c1C(=O)O.Cc1ncsc1C(=O)Nc1csc(-c2cnccn2)c1C(=O)O.Cn1ccc(C(=O)Nc2csc(-c3cnccn3)c2C(=O)O)c1Cl.Cn1cnc(C(=O)Nc2csc(-c3cnccn3)c2C(=O)O)c1.
What is the InChIKey of 4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid?
The InChIKey is VTQGAZLTCFWCKV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H20N6O3S.C15H11ClN4O3S.C14H11N5O3S.C14H10N4O3S2.CH4/c1-12-13(9-23-20(24-12)26-7-3-2-4-8-26)17-16(19(28)29)15(11-30-17)25-18(27)14-10-21-5-6-22-14;1-12-14(9-23-20(24-12)26-5-3-2-4-6-26)17-16(19(28)29)15(10-30-17)25-18(27)13-7-21-11-22-8-13;1-20-5-2-8(13(20)16)14(21)19-10-7-24-12(11(10)15(22)23)9-6-17-3-4-18-9;1-19-5-9(17-7-19)13(20)18-10-6-23-12(11(10)14(21)22)8-4-15-2-3-16-8;1-7-11(23-6-17-7)13(19)18-9-5-22-12(10(9)14(20)21)8-4-15-2-3-16-8;/h5-6,9-11H,2-4,7-8H2,1H3,(H,25,27)(H,28,29);7-11H,2-6H2,1H3,(H,25,27)(H,28,29);2-7H,1H3,(H,19,21)(H,22,23);2-7H,1H3,(H,18,20)(H,21,22);2-6H,1H3,(H,18,19)(H,20,21);1H4.
What are the key properties of 4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid?
4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid has a molecular weight of 1903.55 g/mol, XLogP of 15.08, 22 rotatable bonds, 10 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-chloro-1-methylpyrrole-3-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;methane;4-[(1-methylimidazole-4-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid;2-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid;4-[(4-methyl-1,3-thiazole-5-carbonyl)amino]-2-pyrazin-2-ylthiophene-3-carboxylic acid is sourced from PubChem (CID 161396258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).