N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea

C114H116N30O16S2 — CID 159279457

IUPACN-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea
SMILESCCNc1cc(NC(=O)c2cccc(C)c2)nc(NC(=O)c2ccc(C(C)(C)C)cc2)n1.CCNc1cc(NC(=O)c2cccc(C)c2)nc(NC(=O)c2cccc(OC)c2)n1.CN(C(=O)Nc1ccnc(NC(=O)N(C)c2ccccc2)n1)c1ccccc1.COc1cccc(C(=O)Nc2nc(N)cc(OC)n2)c1.O=C(Nc1ccccc1)Nc1ccnc(NC(=O)Nc2ccccc2)n1.O=S(=O)(Nc1ccnc(NS(=O)(=O)c2ccccc2)n1)c1ccccc1
InChIInChI=1S/C25H29N5O2.C22H23N5O3.C20H20N6O2.C18H16N6O2.C16H14N4O4S2.C13H14N4O3/c1-6-26-20-15-21(27-23(32)18-9-7-8-16(2)14-18)29-24(28-20)30-22(31)17-10-12-19(13-11-17)25(3,4)5;1-4-23-18-13-19(24-20(28)15-8-5-7-14(2)11-15)26-22(25-18)27-21(29)16-9-6-10-17(12-16)30-3;1-25(15-9-5-3-6-10-15)19(27)23-17-13-14-21-18(22-17)24-20(28)26(2)16-11-7-4-8-12-16;25-17(20-13-7-3-1-4-8-13)23-15-11-12-19-16(22-15)24-18(26)21-14-9-5-2-6-10-14;21-25(22,13-7-3-1-4-8-13)19-15-11-12-17-16(18-15)20-26(23,24)14-9-5-2-6-10-14;1-19-9-5-3-4-8(6-9)12(18)17-13-15-10(14)7-11(16-13)20-2/h7-15H,6H2,1-5H3,(H3,26,27,28,29,30,31,32);5-13H,4H2,1-3H3,(H3,23,24,25,26,27,28,29);3-14H,1-2H3,(H2,21,22,23,24,27,28);1-12H,(H4,19,20,21,22,23,24,25,26);1-12H,(H2,17,18,19,20);3-7H,1-2H3,(H3,14,15,16,17,18)
InChIKeyKYSMKEHPCZRXBB-UHFFFAOYSA-N
MW2226.51 g/mol
LogP19.73
Rot. Bonds31

About N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea

N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea (PubChem CID 159279457) has the molecular formula C114H116N30O16S2 and a molecular weight of 2226.51 g/mol. Its IUPAC name is N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea.

Molecular Properties

Compound NameN-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea
PubChem CID159279457
Molecular FormulaC114H116N30O16S2
Molecular Weight2226.51 g/mol
Exact Mass2224.86
IUPAC NameN-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea
SMILESCCNc1cc(NC(=O)c2cccc(C)c2)nc(NC(=O)c2ccc(C(C)(C)C)cc2)n1.CCNc1cc(NC(=O)c2cccc(C)c2)nc(NC(=O)c2cccc(OC)c2)n1.CN(C(=O)Nc1ccnc(NC(=O)N(C)c2ccccc2)n1)c1ccccc1.COc1cccc(C(=O)Nc2nc(N)cc(OC)n2)c1.O=C(Nc1ccccc1)Nc1ccnc(NC(=O)Nc2ccccc2)n1.O=S(=O)(Nc1ccnc(NS(=O)(=O)c2ccccc2)n1)c1ccccc1
InChIInChI=1S/C25H29N5O2.C22H23N5O3.C20H20N6O2.C18H16N6O2.C16H14N4O4S2.C13H14N4O3/c1-6-26-20-15-21(27-23(32)18-9-7-8-16(2)14-18)29-24(28-20)30-22(31)17-10-12-19(13-11-17)25(3,4)5;1-4-23-18-13-19(24-20(28)15-8-5-7-14(2)11-15)26-22(25-18)27-21(29)16-9-6-10-17(12-16)30-3;1-25(15-9-5-3-6-10-15)19(27)23-17-13-14-21-18(22-17)24-20(28)26(2)16-11-7-4-8-12-16;25-17(20-13-7-3-1-4-8-13)23-15-11-12-19-16(22-15)24-18(26)21-14-9-5-2-6-10-14;21-25(22,13-7-3-1-4-8-13)19-15-11-12-17-16(18-15)20-26(23,24)14-9-5-2-6-10-14;1-19-9-5-3-4-8(6-9)12(18)17-13-15-10(14)7-11(16-13)20-2/h7-15H,6H2,1-5H3,(H3,26,27,28,29,30,31,32);5-13H,4H2,1-3H3,(H3,23,24,25,26,27,28,29);3-14H,1-2H3,(H2,21,22,23,24,27,28);1-12H,(H4,19,20,21,22,23,24,25,26);1-12H,(H2,17,18,19,20);3-7H,1-2H3,(H3,14,15,16,17,18)
InChIKeyKYSMKEHPCZRXBB-UHFFFAOYSA-N
XLogP19.73
TPSA617.23 Ų
H-Bond Donors16
H-Bond Acceptors31
Rotatable Bonds31
Heavy Atoms162
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002226.51
LogP ≤ 519.73
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1031

Analyze N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea with MolForge

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Related Compounds

tert-butyl 7-[3-[6-[[4-[[4-[3-[4-(benzylamino)pyrimidin-2-yl]-4-[[2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinolin-7-yl]oxy]pyrrolo[2,3-b]pyridin-1-yl]sulfonylphenyl]methyl]benzoyl]amino]pyrimidin-4-yl]-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridin-4-yl]oxy-3,4-dihydro-1H-isoquinoline-2-carboxylate
CID 146275040
N-(4-anilinopyrimidin-2-yl)-3-methoxybenzamide;N-(2-benzamido-6-morpholin-4-ylpyrimidin-4-yl)benzamide;N-[4-(dimethylamino)pyrimidin-2-yl]-3-methoxy-N-methylbenzamide;4-(dimethylsulfamoyl)-N-[2-[[4-(dimethylsulfamoyl)benzoyl]amino]-6-methylpyrimidin-4-yl]benzamide;3-methyl-N-[2-[(3-methylbenzoyl)amino]-6-morpholin-4-ylpyrimidin-4-yl]benzamide;3-methyl-N-[2-[(3-methylbenzoyl)amino]-6-phenylpyrimidin-4-yl]benzamide
CID 157073938
N-[2-[(3,4-dimethylbenzoyl)amino]-6-methoxypyrimidin-4-yl]-3,4-dimethylbenzamide;4-N-[4-[(4-formamidobenzoyl)amino]-6-methoxypyrimidin-2-yl]benzene-1,4-dicarboxamide;3-(hydroxymethyl)-N-[6-methoxy-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]benzamide;4-(hydroxymethyl)-N-[6-methoxy-2-[(4-methoxybenzoyl)amino]pyrimidin-4-yl]benzamide;N-[6-methoxy-2-[(4-octoxybenzoyl)amino]pyrimidin-4-yl]-4-methylbenzamide;4-methoxy-2-[(4-sulfamoylbenzoyl)amino]-6-[[4-(sulfinatoamino)benzoyl]amino]pyrimidine;N-[6-methoxy-2-[[4-(2,4,4-trimethylpentan-2-yl)benzoyl]amino]pyrimidin-4-yl]-4-(2,4,4-trimethylpentan-2-yl)benzamide
CID 157206045
4-tert-butyl-N-[2-[(4-tert-butylbenzoyl)amino]-6-methylpyrimidin-4-yl]benzamide;4-N-[4-[(4-formamidobenzoyl)amino]-6-methylpyrimidin-2-yl]benzene-1,4-dicarboxamide;3-(hydroxymethyl)-N-[2-[(3-methoxybenzoyl)amino]-6-methylpyrimidin-4-yl]benzamide;4-(hydroxymethyl)-N-[2-[(4-methoxybenzoyl)amino]-6-methylpyrimidin-4-yl]benzamide;4-methyl-N-[6-methyl-2-[(4-octoxybenzoyl)amino]pyrimidin-4-yl]benzamide;4-methyl-2-[(4-sulfamoylbenzoyl)amino]-6-[[4-(sulfinatoamino)benzoyl]amino]pyrimidine;N-[6-methyl-2-[[4-(2,4,4-trimethylpentan-2-yl)benzoyl]amino]pyrimidin-4-yl]-4-(2,4,4-trimethylpentan-2-yl)benzamide
CID 157277821
4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide
CID 157440647
N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;3-methyl-N-[2-[(3-methylbenzoyl)amino]-6-phenylpyrimidin-4-yl]benzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;phenyl N-[2-(phenoxycarbonylamino)pyrimidin-4-yl]carbamate;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea
CID 157590998
N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-(6-benzamido-2-pyridinyl)benzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;4-(hydroxymethyl)-N-[6-[(4-methoxybenzoyl)amino]-2-pyridinyl]benzamide;3-methyl-N-[6-[(3-methylbenzoyl)amino]-2-pyridinyl]benzamide;N-methyl-N-[4-methyl-6-[methyl(octanoyl)amino]-2-pyridinyl]octanamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea
CID 157714469
N-[[4-(dimethylamino)phenyl]methyl]-5,8-dimethyl-6-methylidene-7H-pteridin-2-amine;4-[[(5,8-dimethyl-6-methylidene-7H-pteridin-2-yl)amino]methyl]benzenesulfonamide;1-[4-[[(5,8-dimethyl-6-methylidene-7H-pteridin-2-yl)amino]methyl]phenyl]-3-phenylpropan-1-one;N-[(4-fluorophenyl)methyl]-5,8-dimethyl-6-methylidene-7H-pteridin-2-amine;methane;N-[(2-methoxyphenyl)methyl]-5,8-dimethyl-6-methylidene-7H-pteridin-2-amine
CID 157889349
N-(4-anilinopyrimidin-2-yl)-3-methoxybenzamide;N-(4-tert-butyl-6-morpholin-4-ylpyrimidin-2-yl)benzamide;1-N-[2-[[4-(dimethylcarbamoyl)benzoyl]amino]-6-methylpyrimidin-4-yl]-4-N,4-N-dimethylbenzene-1,4-dicarboxamide;4-(dimethylsulfamoyl)-N-[2-[[4-(dimethylsulfamoyl)benzoyl]amino]-6-methylpyrimidin-4-yl]benzamide;4-methyl-N-[6-methyl-2-[(4-octoxybenzoyl)amino]pyrimidin-4-yl]benzamide;N-[6-methyl-2-[[4-(2,4,4-trimethylpentan-2-yl)benzoyl]amino]pyrimidin-4-yl]-4-(2,4,4-trimethylpentan-2-yl)benzamide
CID 157948171
N-(4-anilinopyrimidin-2-yl)-3-methoxybenzamide;N-[4-(dimethylamino)pyrimidin-2-yl]-3-methoxy-N-methylbenzamide;3-methyl-N-[2-[(3-methylbenzoyl)amino]-6-morpholin-4-ylpyrimidin-4-yl]benzamide;3-methyl-N-[2-[(3-methylbenzoyl)amino]-6-phenylpyrimidin-4-yl]benzamide;phenyl N-[2-(phenoxycarbonylamino)pyrimidin-4-yl]carbamate
CID 158214039
N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-(6-benzamido-2-pyridinyl)benzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;phenyl N-[2-(phenoxycarbonylamino)pyrimidin-4-yl]carbamate;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea
CID 158260377
4-tert-butyl-N-[2-[(4-tert-butylbenzoyl)amino]-6-methylpyrimidin-4-yl]benzamide;N-(4-tert-butyl-6-morpholin-4-ylpyrimidin-2-yl)benzamide;1-N-[2-[[4-(dimethylcarbamoyl)benzoyl]amino]-6-methylpyrimidin-4-yl]-4-N,4-N-dimethylbenzene-1,4-dicarboxamide;4-(dimethylsulfamoyl)-N-[2-[[4-(dimethylsulfamoyl)benzoyl]amino]-6-methylpyrimidin-4-yl]benzamide;4-methyl-N-[6-methyl-2-[(4-octoxybenzoyl)amino]pyrimidin-4-yl]benzamide;N-[6-methyl-2-[[4-(2,4,4-trimethylpentan-2-yl)benzoyl]amino]pyrimidin-4-yl]-4-(2,4,4-trimethylpentan-2-yl)benzamide
CID 158649242

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea?
The IUPAC name of N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea (CID 159279457) is N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea.
What is the SMILES notation for N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea?
The canonical SMILES for N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea is CCNc1cc(NC(=O)c2cccc(C)c2)nc(NC(=O)c2ccc(C(C)(C)C)cc2)n1.CCNc1cc(NC(=O)c2cccc(C)c2)nc(NC(=O)c2cccc(OC)c2)n1.CN(C(=O)Nc1ccnc(NC(=O)N(C)c2ccccc2)n1)c1ccccc1.COc1cccc(C(=O)Nc2nc(N)cc(OC)n2)c1.O=C(Nc1ccccc1)Nc1ccnc(NC(=O)Nc2ccccc2)n1.O=S(=O)(Nc1ccnc(NS(=O)(=O)c2ccccc2)n1)c1ccccc1.
What is the InChIKey of N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea?
The InChIKey is KYSMKEHPCZRXBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N5O2.C22H23N5O3.C20H20N6O2.C18H16N6O2.C16H14N4O4S2.C13H14N4O3/c1-6-26-20-15-21(27-23(32)18-9-7-8-16(2)14-18)29-24(28-20)30-22(31)17-10-12-19(13-11-17)25(3,4)5;1-4-23-18-13-19(24-20(28)15-8-5-7-14(2)11-15)26-22(25-18)27-21(29)16-9-6-10-17(12-16)30-3;1-25(15-9-5-3-6-10-15)19(27)23-17-13-14-21-18(22-17)24-20(28)26(2)16-11-7-4-8-12-16;25-17(20-13-7-3-1-4-8-13)23-15-11-12-19-16(22-15)24-18(26)21-14-9-5-2-6-10-14;21-25(22,13-7-3-1-4-8-13)19-15-11-12-17-16(18-15)20-26(23,24)14-9-5-2-6-10-14;1-19-9-5-3-4-8(6-9)12(18)17-13-15-10(14)7-11(16-13)20-2/h7-15H,6H2,1-5H3,(H3,26,27,28,29,30,31,32);5-13H,4H2,1-3H3,(H3,23,24,25,26,27,28,29);3-14H,1-2H3,(H2,21,22,23,24,27,28);1-12H,(H4,19,20,21,22,23,24,25,26);1-12H,(H2,17,18,19,20);3-7H,1-2H3,(H3,14,15,16,17,18).
What are the key properties of N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea?
N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea has a molecular weight of 2226.51 g/mol, XLogP of 19.73, 31 rotatable bonds, 16 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-6-methoxypyrimidin-2-yl)-3-methoxybenzamide;N-[2-(benzenesulfonamido)pyrimidin-4-yl]benzenesulfonamide;N-[2-[(4-tert-butylbenzoyl)amino]-6-(ethylamino)pyrimidin-4-yl]-3-methylbenzamide;N-[6-(ethylamino)-2-[(3-methoxybenzoyl)amino]pyrimidin-4-yl]-3-methylbenzamide;1-methyl-3-[2-[[methyl(phenyl)carbamoyl]amino]pyrimidin-4-yl]-1-phenylurea;1-phenyl-3-[2-(phenylcarbamoylamino)pyrimidin-4-yl]urea is sourced from PubChem (CID 159279457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).