1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride

C216H231ClFN67O18 — CID 160566895

IUPAC1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride
SMILESCC(=O)OCCNC(=O)Nc1ccc2ncc(-c3ccccc3)nc2n1.CCNC(=O)Nc1ccc2ncc(-c3cc(C)ccc3OC)nc2n1.CCNC(=O)Nc1ccc2ncc(-c3ccc(C)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(-c3cccc(C(=O)NC)c3)nc2n1.CCNC(=O)Nc1ccc2ncc(N(C)c3ccc(C)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(NCCc3ccc(C)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(NCc3ccc(C)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ccc(C)c(C)c3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ccc(C)c(F)c3)nc2n1.Cl.NCCCCNC(=O)Nc1ccc2ncc(-c3ccccc3)nc2n1.O=C(NCCCCCO)Nc1ccc2ncc(-c3ccccc3)nc2n1.O=C(NCCCCO)Nc1ccc2ncc(-c3ccccc3)nc2n1
InChIInChI=1S/C19H22N6O.C19H21N5O2.C18H18N6O2.4C18H20N6O.C18H17N5O3.2C18H19N5O2.C17H17FN6O.C17H17N5O.ClH/c1-3-20-19(26)25-16-9-8-15-18(23-16)24-17(12-22-15)21-11-10-14-6-4-13(2)5-7-14;25-12-6-2-5-11-20-19(26)24-17-10-9-15-18(23-17)22-16(13-21-15)14-7-3-1-4-8-14;1-3-20-18(26)24-15-8-7-13-16(23-15)22-14(10-21-13)11-5-4-6-12(9-11)17(25)19-2;1-4-19-18(25)22-15-10-9-14-17(21-15)23-16(11-20-14)24(3)13-7-5-12(2)6-8-13;1-4-19-18(25)24-15-8-7-14-17(22-15)23-16(10-20-14)21-13-6-5-11(2)12(3)9-13;1-3-19-18(25)24-15-9-8-14-17(22-15)23-16(11-20-14)21-10-13-6-4-12(2)5-7-13;19-10-4-5-11-20-18(25)24-16-9-8-14-17(23-16)22-15(12-21-14)13-6-2-1-3-7-13;1-12(24)26-10-9-19-18(25)23-16-8-7-14-17(22-16)21-15(11-20-14)13-5-3-2-4-6-13;1-4-19-18(24)23-16-8-6-13-17(22-16)21-14(10-20-13)12-9-11(2)5-7-15(12)25-3;24-11-5-4-10-19-18(25)23-16-9-8-14-17(22-16)21-15(12-20-14)13-6-2-1-3-7-13;1-3-19-17(25)24-14-7-6-13-16(22-14)23-15(9-20-13)21-11-5-4-10(2)12(18)8-11;1-3-18-17(23)22-15-9-8-13-16(21-15)20-14(10-19-13)12-6-4-11(2)5-7-12;/h4-9,12H,3,10-11H2,1-2H3,(H3,20,21,23,24,25,26);1,3-4,7-10,13,25H,2,5-6,11-12H2,(H2,20,22,23,24,26);4-10H,3H2,1-2H3,(H,19,25)(H2,20,22,23,24,26);5-11H,4H2,1-3H3,(H2,19,21,22,23,25);5-10H,4H2,1-3H3,(H3,19,21,22,23,24,25);4-9,11H,3,10H2,1-2H3,(H3,19,21,22,23,24,25);1-3,6-9,12H,4-5,10-11,19H2,(H2,20,22,23,24,25);2-8,11H,9-10H2,1H3,(H2,19,21,22,23,25);5-10H,4H2,1-3H3,(H2,19,21,22,23,24);1-3,6-9,12,24H,4-5,10-11H2,(H2,19,21,22,23,25);4-9H,3H2,1-2H3,(H3,19,21,22,23,24,25);4-10H,3H2,1-2H3,(H2,18,20,21,22,23);1H
InChIKeyJHVOCQBQSAARAV-UHFFFAOYSA-N
MW4108.13 g/mol
LogP35.74
Rot. Bonds58

About 1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride

1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride (PubChem CID 160566895) has the molecular formula C216H231ClFN67O18 and a molecular weight of 4108.13 g/mol. Its IUPAC name is 1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride.

Molecular Properties

Compound Name1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride
PubChem CID160566895
Molecular FormulaC216H231ClFN67O18
Molecular Weight4108.13 g/mol
Exact Mass4104.89
IUPAC Name1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride
SMILESCC(=O)OCCNC(=O)Nc1ccc2ncc(-c3ccccc3)nc2n1.CCNC(=O)Nc1ccc2ncc(-c3cc(C)ccc3OC)nc2n1.CCNC(=O)Nc1ccc2ncc(-c3ccc(C)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(-c3cccc(C(=O)NC)c3)nc2n1.CCNC(=O)Nc1ccc2ncc(N(C)c3ccc(C)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(NCCc3ccc(C)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(NCc3ccc(C)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ccc(C)c(C)c3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ccc(C)c(F)c3)nc2n1.Cl.NCCCCNC(=O)Nc1ccc2ncc(-c3ccccc3)nc2n1.O=C(NCCCCCO)Nc1ccc2ncc(-c3ccccc3)nc2n1.O=C(NCCCCO)Nc1ccc2ncc(-c3ccccc3)nc2n1
InChIInChI=1S/C19H22N6O.C19H21N5O2.C18H18N6O2.4C18H20N6O.C18H17N5O3.2C18H19N5O2.C17H17FN6O.C17H17N5O.ClH/c1-3-20-19(26)25-16-9-8-15-18(23-16)24-17(12-22-15)21-11-10-14-6-4-13(2)5-7-14;25-12-6-2-5-11-20-19(26)24-17-10-9-15-18(23-17)22-16(13-21-15)14-7-3-1-4-8-14;1-3-20-18(26)24-15-8-7-13-16(23-15)22-14(10-21-13)11-5-4-6-12(9-11)17(25)19-2;1-4-19-18(25)22-15-10-9-14-17(21-15)23-16(11-20-14)24(3)13-7-5-12(2)6-8-13;1-4-19-18(25)24-15-8-7-14-17(22-15)23-16(10-20-14)21-13-6-5-11(2)12(3)9-13;1-3-19-18(25)24-15-9-8-14-17(22-15)23-16(11-20-14)21-10-13-6-4-12(2)5-7-13;19-10-4-5-11-20-18(25)24-16-9-8-14-17(23-16)22-15(12-21-14)13-6-2-1-3-7-13;1-12(24)26-10-9-19-18(25)23-16-8-7-14-17(22-16)21-15(11-20-14)13-5-3-2-4-6-13;1-4-19-18(24)23-16-8-6-13-17(22-16)21-14(10-20-13)12-9-11(2)5-7-15(12)25-3;24-11-5-4-10-19-18(25)23-16-9-8-14-17(22-16)21-15(12-20-14)13-6-2-1-3-7-13;1-3-19-17(25)24-14-7-6-13-16(22-14)23-15(9-20-13)21-11-5-4-10(2)12(18)8-11;1-3-18-17(23)22-15-9-8-13-16(21-15)20-14(10-19-13)12-6-4-11(2)5-7-12;/h4-9,12H,3,10-11H2,1-2H3,(H3,20,21,23,24,25,26);1,3-4,7-10,13,25H,2,5-6,11-12H2,(H2,20,22,23,24,26);4-10H,3H2,1-2H3,(H,19,25)(H2,20,22,23,24,26);5-11H,4H2,1-3H3,(H2,19,21,22,23,25);5-10H,4H2,1-3H3,(H3,19,21,22,23,24,25);4-9,11H,3,10H2,1-2H3,(H3,19,21,22,23,24,25);1-3,6-9,12H,4-5,10-11,19H2,(H2,20,22,23,24,25);2-8,11H,9-10H2,1H3,(H2,19,21,22,23,25);5-10H,4H2,1-3H3,(H2,19,21,22,23,24);1-3,6-9,12,24H,4-5,10-11H2,(H2,19,21,22,23,25);4-9H,3H2,1-2H3,(H3,19,21,22,23,24,25);4-10H,3H2,1-2H3,(H2,18,20,21,22,23);1H
InChIKeyJHVOCQBQSAARAV-UHFFFAOYSA-N
XLogP35.74
TPSA1140.07 Ų
H-Bond Donors32
H-Bond Acceptors60
Rotatable Bonds58
Heavy Atoms303
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004108.13
LogP ≤ 535.74
H-Bond Donors ≤ 532
H-Bond Acceptors ≤ 1060

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride with MolForge

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Related Compounds

N-[(3-tert-butylphenyl)methyl]-3-[[6-[2-(dimethylamino)ethyl-methylamino]-1-[[4-[[4-methoxy-3-(trifluoromethyl)phenyl]carbamoyl]-2-[[1-[[4-[[4-methoxy-3-(trifluoromethyl)phenyl]carbamoyl]-2-[[6-(4-methylpiperazin-1-yl)pyrimido[5,4-d]pyrimidin-4-yl]amino]phenyl]methyl]-6-morpholin-4-ylpyrimido[5,4-d]pyrimidin-1-ium-4-yl]amino]phenyl]methyl]pyrimido[5,4-d]pyrimidin-1-ium-4-yl]amino]-4-methylbenzamide
CID 90936133
5-[5-[5-[[4-Carboxy-4-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]butanoyl]amino]pentyl-[2-[2-[2-[[4-(2,7-difluoro-3-hydroxy-6-oxoxanthen-9-yl)-3-methylbenzoyl]amino]ethoxy]ethoxy]ethyl]amino]pentylamino]-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid
CID 122674640
N-ethyl-4-[[(1S)-1-[8-(2-methoxy-4-pyridinyl)-1-oxo-2-phenylisoquinolin-3-yl]ethyl]amino]-2-methylpyrimidine-5-carboxamide;N-(2-hydroxyethyl)-2-methyl-4-[[(1S)-1-[8-(2-methyl-4-pyridinyl)-1-oxo-2-phenylisoquinolin-3-yl]ethyl]amino]pyrimidine-5-carboxamide;3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenyl-8-[5-(trifluoromethoxy)-3-pyridinyl]isoquinolin-1-one;methane;8-(2-methoxy-4-pyridinyl)-3-[(1S)-1-[(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one
CID 157126534
1-[3-(3-chloro-4-fluorophenyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-[6-chloro-5-(trifluoromethyl)-3-pyridinyl]pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(cyclopropylmethylamino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(2,4-difluorophenyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;4-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]benzoic acid;N-[4-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]phenyl]acetamide;1-ethyl-3-[3-(4-fluorophenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-hydroxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxyethylamino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylpiperazin-1-yl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-(3-morpholin-4-ylpyrido[2,3-b]pyrazin-6-yl)urea;1-ethyl-3-(3-phenoxypyrido[2,3-b]pyrazin-6-yl)urea
CID 157358120
2-[1-[[amino-[(4,6-dimethylquinazolin-2-yl)amino]methylidene]amino]ethyl]benzoic acid;2-[[N'-(4,6-dimethylquinazolin-2-yl)carbamimidoyl]carbamoyl]benzoic acid;1-(4,6-dimethylquinazolin-2-yl)-2-[1-(2,4,6-trimethoxyphenyl)ethyl]guanidine;1-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-3-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]propan-2-one
CID 157715639
3-[2-(1-aminoisoquinolin-4-yl)ethynyl]-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide;3-[2-(8-amino-1,7-naphthyridin-5-yl)ethynyl]-N-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-4-methylbenzamide;3-[2-(8-amino-1,7-naphthyridin-5-yl)ethynyl]-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide
CID 158495133
1-[3-(3-Acetyl-2-fluorophenyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(3-amino-4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(3,5-difluoro-2-methoxyphenyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(6-ethoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-ethyl-3-[3-(2-fluoro-3-methoxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(3-fluoro-4-methoxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-fluoro-4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methoxy-3-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[4-(trifluoromethyl)phenyl]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(3,4,5-trimethoxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-morpholin-4-ylbutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(6-oxoheptyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea
CID 158520469
3-[2-(3-amino-1-methylisoquinolin-4-yl)ethynyl]-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide;3-[2-(3-amino-6-methylisoquinolin-4-yl)ethynyl]-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide;3-[2-(8-amino-1,7-naphthyridin-5-yl)ethynyl]-N-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-4-methylbenzamide
CID 158877128
CID 159867515
CID 159867515
1-[3-(3-acetyl-2-fluorophenyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(3-amino-4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(3,5-difluoro-2-methoxyphenyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(6-ethoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-ethyl-3-[3-(2-fluoro-3-methoxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(3-fluoro-4-methoxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-fluoro-4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methoxy-3-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[4-(trifluoromethyl)phenyl]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(3,4,5-trimethoxyphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-morpholin-4-ylbutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;N-[4-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]butyl]acetamide
CID 159878316
2-[1-[[amino-[(4,6-dimethylquinazolin-2-yl)amino]methylidene]amino]ethyl]benzoic acid;2-[[N'-(4,6-dimethylquinazolin-2-yl)carbamimidoyl]carbamoyl]benzoic acid;1-(4,6-dimethylquinazolin-2-yl)-2-[1-(2,4,6-trimethoxyphenyl)ethyl]guanidine;2-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-1-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]guanidine
CID 160180367
(3R,4R)-N-benzyl-3-[4-(hydroxymethyl)phenyl]-1-oxo-2-[[4-(trifluoromethoxy)phenyl]methyl]-3,4-dihydroisoquinoline-4-carboxamide;(3R,4R)-2-[[3-(1,1-difluoroethyl)-5-fluorophenyl]methyl]-3-[4-(hydroxymethyl)phenyl]-N-[2-(4-methoxyphenyl)ethyl]-1-oxo-3,4-dihydroisoquinoline-4-carboxamide;(3R,4R)-N-[3-(dimethylamino)propyl]-3-(4-ethylphenyl)-2-[(2-methoxyphenyl)methyl]-1-oxo-3,4-dihydroisoquinoline-4-carboxamide;(3R,4R)-3-[4-(hydroxymethyl)phenyl]-2-(5-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide
CID 160415761

Frequently Asked Questions

What is the IUPAC name of 1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride?
The IUPAC name of 1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride (CID 160566895) is 1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride.
What is the SMILES notation for 1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride?
The canonical SMILES for 1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride is CC(=O)OCCNC(=O)Nc1ccc2ncc(-c3ccccc3)nc2n1.CCNC(=O)Nc1ccc2ncc(-c3cc(C)ccc3OC)nc2n1.CCNC(=O)Nc1ccc2ncc(-c3ccc(C)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(-c3cccc(C(=O)NC)c3)nc2n1.CCNC(=O)Nc1ccc2ncc(N(C)c3ccc(C)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(NCCc3ccc(C)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(NCc3ccc(C)cc3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ccc(C)c(C)c3)nc2n1.CCNC(=O)Nc1ccc2ncc(Nc3ccc(C)c(F)c3)nc2n1.Cl.NCCCCNC(=O)Nc1ccc2ncc(-c3ccccc3)nc2n1.O=C(NCCCCCO)Nc1ccc2ncc(-c3ccccc3)nc2n1.O=C(NCCCCO)Nc1ccc2ncc(-c3ccccc3)nc2n1.
What is the InChIKey of 1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride?
The InChIKey is JHVOCQBQSAARAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O.C19H21N5O2.C18H18N6O2.4C18H20N6O.C18H17N5O3.2C18H19N5O2.C17H17FN6O.C17H17N5O.ClH/c1-3-20-19(26)25-16-9-8-15-18(23-16)24-17(12-22-15)21-11-10-14-6-4-13(2)5-7-14;25-12-6-2-5-11-20-19(26)24-17-10-9-15-18(23-17)22-16(13-21-15)14-7-3-1-4-8-14;1-3-20-18(26)24-15-8-7-13-16(23-15)22-14(10-21-13)11-5-4-6-12(9-11)17(25)19-2;1-4-19-18(25)22-15-10-9-14-17(21-15)23-16(11-20-14)24(3)13-7-5-12(2)6-8-13;1-4-19-18(25)24-15-8-7-14-17(22-15)23-16(10-20-14)21-13-6-5-11(2)12(3)9-13;1-3-19-18(25)24-15-9-8-14-17(22-15)23-16(11-20-14)21-10-13-6-4-12(2)5-7-13;19-10-4-5-11-20-18(25)24-16-9-8-14-17(23-16)22-15(12-21-14)13-6-2-1-3-7-13;1-12(24)26-10-9-19-18(25)23-16-8-7-14-17(22-16)21-15(11-20-14)13-5-3-2-4-6-13;1-4-19-18(24)23-16-8-6-13-17(22-16)21-14(10-20-13)12-9-11(2)5-7-15(12)25-3;24-11-5-4-10-19-18(25)23-16-9-8-14-17(22-16)21-15(12-20-14)13-6-2-1-3-7-13;1-3-19-17(25)24-14-7-6-13-16(22-14)23-15(9-20-13)21-11-5-4-10(2)12(18)8-11;1-3-18-17(23)22-15-9-8-13-16(21-15)20-14(10-19-13)12-6-4-11(2)5-7-12;/h4-9,12H,3,10-11H2,1-2H3,(H3,20,21,23,24,25,26);1,3-4,7-10,13,25H,2,5-6,11-12H2,(H2,20,22,23,24,26);4-10H,3H2,1-2H3,(H,19,25)(H2,20,22,23,24,26);5-11H,4H2,1-3H3,(H2,19,21,22,23,25);5-10H,4H2,1-3H3,(H3,19,21,22,23,24,25);4-9,11H,3,10H2,1-2H3,(H3,19,21,22,23,24,25);1-3,6-9,12H,4-5,10-11,19H2,(H2,20,22,23,24,25);2-8,11H,9-10H2,1H3,(H2,19,21,22,23,25);5-10H,4H2,1-3H3,(H2,19,21,22,23,24);1-3,6-9,12,24H,4-5,10-11H2,(H2,19,21,22,23,25);4-9H,3H2,1-2H3,(H3,19,21,22,23,24,25);4-10H,3H2,1-2H3,(H2,18,20,21,22,23);1H.
What are the key properties of 1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride?
1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride has a molecular weight of 4108.13 g/mol, XLogP of 35.74, 58 rotatable bonds, 32 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-aminobutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-[3-(3,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;1-[3-(N,4-dimethylanilino)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea;3-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]-N-methylbenzamide;1-ethyl-3-[3-(3-fluoro-4-methylanilino)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(2-methoxy-5-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[2-(4-methylphenyl)ethylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-[(4-methylphenyl)methylamino]pyrido[2,3-b]pyrazin-6-yl]urea;1-ethyl-3-[3-(4-methylphenyl)pyrido[2,3-b]pyrazin-6-yl]urea;1-(4-hydroxybutyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;1-(5-hydroxypentyl)-3-(3-phenylpyrido[2,3-b]pyrazin-6-yl)urea;2-[(3-phenylpyrido[2,3-b]pyrazin-6-yl)carbamoylamino]ethyl acetate;hydrochloride is sourced from PubChem (CID 160566895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).