3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide

C90H104N22O12S4 — CID 161102163

IUPAC3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide
SMILESCC(CN(C)C)S(=O)(=O)c1ccc(-c2cnc(N)c(C(=O)Nc3ccccc3)n2)cc1.CCN(CC)CCS(=O)(=O)c1ccc(-c2cnc(N)c(C(=O)Nc3ccccc3)n2)cc1.CN(C)CCNS(=O)(=O)c1ccc(-c2cnc(N)c(C(=O)Nc3ccccc3)n2)cc1.CN1CCN(CCS(=O)(=O)c2ccc(-c3cnc(N)c(C(=O)Nc4ccccc4)n3)cc2)CC1
InChIInChI=1S/C24H28N6O3S.C23H27N5O3S.C22H25N5O3S.C21H24N6O3S/c1-29-11-13-30(14-12-29)15-16-34(32,33)20-9-7-18(8-10-20)21-17-26-23(25)22(28-21)24(31)27-19-5-3-2-4-6-19;1-3-28(4-2)14-15-32(30,31)19-12-10-17(11-13-19)20-16-25-22(24)21(27-20)23(29)26-18-8-6-5-7-9-18;1-15(14-27(2)3)31(29,30)18-11-9-16(10-12-18)19-13-24-21(23)20(26-19)22(28)25-17-7-5-4-6-8-17;1-27(2)13-12-24-31(29,30)17-10-8-15(9-11-17)18-14-23-20(22)19(26-18)21(28)25-16-6-4-3-5-7-16/h2-10,17H,11-16H2,1H3,(H2,25,26)(H,27,31);5-13,16H,3-4,14-15H2,1-2H3,(H2,24,25)(H,26,29);4-13,15H,14H2,1-3H3,(H2,23,24)(H,25,28);3-11,14,24H,12-13H2,1-2H3,(H2,22,23)(H,25,28)
InChIKeyUIOOXJPLQYRFRC-UHFFFAOYSA-N
MW1814.23 g/mol
LogP9.61
Rot. Bonds31

About 3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide

3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide (PubChem CID 161102163) has the molecular formula C90H104N22O12S4 and a molecular weight of 1814.23 g/mol. Its IUPAC name is 3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide
PubChem CID161102163
Molecular FormulaC90H104N22O12S4
Molecular Weight1814.23 g/mol
Exact Mass1812.71
IUPAC Name3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide
SMILESCC(CN(C)C)S(=O)(=O)c1ccc(-c2cnc(N)c(C(=O)Nc3ccccc3)n2)cc1.CCN(CC)CCS(=O)(=O)c1ccc(-c2cnc(N)c(C(=O)Nc3ccccc3)n2)cc1.CN(C)CCNS(=O)(=O)c1ccc(-c2cnc(N)c(C(=O)Nc3ccccc3)n2)cc1.CN1CCN(CCS(=O)(=O)c2ccc(-c3cnc(N)c(C(=O)Nc4ccccc4)n3)cc2)CC1
InChIInChI=1S/C24H28N6O3S.C23H27N5O3S.C22H25N5O3S.C21H24N6O3S/c1-29-11-13-30(14-12-29)15-16-34(32,33)20-9-7-18(8-10-20)21-17-26-23(25)22(28-21)24(31)27-19-5-3-2-4-6-19;1-3-28(4-2)14-15-32(30,31)19-12-10-17(11-13-19)20-16-25-22(24)21(27-20)23(29)26-18-8-6-5-7-9-18;1-15(14-27(2)3)31(29,30)18-11-9-16(10-12-18)19-13-24-21(23)20(26-19)22(28)25-17-7-5-4-6-8-17;1-27(2)13-12-24-31(29,30)17-10-8-15(9-11-17)18-14-23-20(22)19(26-18)21(28)25-16-6-4-3-5-7-16/h2-10,17H,11-16H2,1H3,(H2,25,26)(H,27,31);5-13,16H,3-4,14-15H2,1-2H3,(H2,24,25)(H,26,29);4-13,15H,14H2,1-3H3,(H2,23,24)(H,25,28);3-11,14,24H,12-13H2,1-2H3,(H2,22,23)(H,25,28)
InChIKeyUIOOXJPLQYRFRC-UHFFFAOYSA-N
XLogP9.61
TPSA488.39 Ų
H-Bond Donors9
H-Bond Acceptors29
Rotatable Bonds31
Heavy Atoms128
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001814.23
LogP ≤ 59.61
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1029

Analyze 3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide with MolForge

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Related Compounds

Azd2858
CID 10138980
VE-821
CID 51000408
3-Amino-6-(4-{[2-(Dimethylamino)ethyl]sulfamoyl}phenyl)-N-Pyridin-3-Ylpyrazine-2-Carboxamide
CID 56962315
3-amino-6-(4-piperidin-1-ylsulfonylphenyl)-N-pyridin-3-ylpyrazine-2-carboxamide
CID 10138033
3-amino-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-[4-(pyrrolidin-1-ylmethyl)-3-pyridinyl]pyrazine-2-carboxamide
CID 10231705
3-amino-6-[4-[2-(dimethylamino)ethyl-ethylsulfamoyl]phenyl]-N-pyridin-3-ylpyrazine-2-carboxamide
CID 10118131
3-amino-6-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-pyridin-3-ylpyrazine-2-carboxamide
CID 10141178
3-Amino-6-[2-fluoro-4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-N-3-pyridinyl-2-pyrazinecarboxamide
CID 10164394
3-amino-6-{3-fluoro-4-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-N-pyridin-3-ylpyrazine-2-carboxamide
CID 10301015
3-Amino-6-[4-[[2-(dimethylamino)-1-methylethyl]sulfonyl]phenyl]-N-phenyl-2-pyrazinecarboxamide
CID 52915004
3-amino-6-[2-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-pyridin-3-ylpyrazine-2-carboxamide
CID 69644160
3-amino-6-(4-(ethylsulfonyl)phenyl)-N-phenylpyrazine-2-carboxamide
CID 52937556

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide?
The IUPAC name of 3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide (CID 161102163) is 3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide?
The canonical SMILES for 3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide is CC(CN(C)C)S(=O)(=O)c1ccc(-c2cnc(N)c(C(=O)Nc3ccccc3)n2)cc1.CCN(CC)CCS(=O)(=O)c1ccc(-c2cnc(N)c(C(=O)Nc3ccccc3)n2)cc1.CN(C)CCNS(=O)(=O)c1ccc(-c2cnc(N)c(C(=O)Nc3ccccc3)n2)cc1.CN1CCN(CCS(=O)(=O)c2ccc(-c3cnc(N)c(C(=O)Nc4ccccc4)n3)cc2)CC1.
What is the InChIKey of 3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide?
The InChIKey is UIOOXJPLQYRFRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N6O3S.C23H27N5O3S.C22H25N5O3S.C21H24N6O3S/c1-29-11-13-30(14-12-29)15-16-34(32,33)20-9-7-18(8-10-20)21-17-26-23(25)22(28-21)24(31)27-19-5-3-2-4-6-19;1-3-28(4-2)14-15-32(30,31)19-12-10-17(11-13-19)20-16-25-22(24)21(27-20)23(29)26-18-8-6-5-7-9-18;1-15(14-27(2)3)31(29,30)18-11-9-16(10-12-18)19-13-24-21(23)20(26-19)22(28)25-17-7-5-4-6-8-17;1-27(2)13-12-24-31(29,30)17-10-8-15(9-11-17)18-14-23-20(22)19(26-18)21(28)25-16-6-4-3-5-7-16/h2-10,17H,11-16H2,1H3,(H2,25,26)(H,27,31);5-13,16H,3-4,14-15H2,1-2H3,(H2,24,25)(H,26,29);4-13,15H,14H2,1-3H3,(H2,23,24)(H,25,28);3-11,14,24H,12-13H2,1-2H3,(H2,22,23)(H,25,28).
What are the key properties of 3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide?
3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide has a molecular weight of 1814.23 g/mol, XLogP of 9.61, 31 rotatable bonds, 9 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-[4-[2-(diethylamino)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(dimethylamino)ethylsulfamoyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[1-(dimethylamino)propan-2-ylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfonyl]phenyl]-N-phenylpyrazine-2-carboxamide is sourced from PubChem (CID 161102163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).