1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea

C148H158Cl4N42O12 — CID 158359968

IUPAC1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea
SMILESCONc1cc(C)nc(NC(=O)Nc2ccc3cc(C)ccc3c2)n1.CONc1cc(C)nc(NC(=O)Nc2ccc3cc(Cl)c(C)cc3c2)n1.Cc1cc(N)nc(NC(=O)Nc2ccc3cc(Cl)c(C)cc3c2)n1.Cc1cc(NCCCN(C)C)nc(NC(=O)Nc2ccc3cc(Cl)c(C)cc3c2)n1.Cc1cc(NO)nc(NC(=O)Nc2ccc3cc(Cl)c(C)cc3c2)n1.Cc1ccc2cc(NC(=O)Nc3nc(C)cc(N)n3)ccc2c1.Cc1ccc2cc(NC(=O)Nc3nc(C)cc(NCCCN(C)C)n3)ccc2c1.Cc1ccc2cc(NC(=O)Nc3nc(C)cc(NO)n3)ccc2c1
InChIInChI=1S/C22H27ClN6O.C22H28N6O.C18H18ClN5O2.C18H19N5O2.C17H16ClN5O2.C17H16ClN5O.C17H17N5O2.C17H17N5O/c1-14-10-17-12-18(7-6-16(17)13-19(14)23)26-22(30)28-21-25-15(2)11-20(27-21)24-8-5-9-29(3)4;1-15-6-7-18-14-19(9-8-17(18)12-15)25-22(29)27-21-24-16(2)13-20(26-21)23-10-5-11-28(3)4;1-10-6-13-8-14(5-4-12(13)9-15(10)19)21-18(25)23-17-20-11(2)7-16(22-17)24-26-3;1-11-4-5-14-10-15(7-6-13(14)8-11)20-18(24)22-17-19-12(2)9-16(21-17)23-25-3;1-9-5-12-7-13(4-3-11(12)8-14(9)18)20-17(24)22-16-19-10(2)6-15(21-16)23-25;1-9-5-12-7-13(4-3-11(12)8-14(9)18)21-17(24)23-16-20-10(2)6-15(19)22-16;1-10-3-4-13-9-14(6-5-12(13)7-10)19-17(23)21-16-18-11(2)8-15(20-16)22-24;1-10-3-4-13-9-14(6-5-12(13)7-10)20-17(23)22-16-19-11(2)8-15(18)21-16/h6-7,10-13H,5,8-9H2,1-4H3,(H3,24,25,26,27,28,30);6-9,12-14H,5,10-11H2,1-4H3,(H3,23,24,25,26,27,29);4-9H,1-3H3,(H3,20,21,22,23,24,25);4-10H,1-3H3,(H3,19,20,21,22,23,24);3-8,25H,1-2H3,(H3,19,20,21,22,23,24);3-8H,1-2H3,(H4,19,20,21,22,23,24);3-9,24H,1-2H3,(H3,18,19,20,21,22,23);3-9H,1-2H3,(H4,18,19,20,21,22,23)
InChIKeyGTISJOLZSRPSAE-UHFFFAOYSA-N
MW2858.99 g/mol
LogP33.18
Rot. Bonds32

About 1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea

1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea (PubChem CID 158359968) has the molecular formula C148H158Cl4N42O12 and a molecular weight of 2858.99 g/mol. Its IUPAC name is 1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea.

Molecular Properties

Compound Name1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea
PubChem CID158359968
Molecular FormulaC148H158Cl4N42O12
Molecular Weight2858.99 g/mol
Exact Mass2855.18
IUPAC Name1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea
SMILESCONc1cc(C)nc(NC(=O)Nc2ccc3cc(C)ccc3c2)n1.CONc1cc(C)nc(NC(=O)Nc2ccc3cc(Cl)c(C)cc3c2)n1.Cc1cc(N)nc(NC(=O)Nc2ccc3cc(Cl)c(C)cc3c2)n1.Cc1cc(NCCCN(C)C)nc(NC(=O)Nc2ccc3cc(Cl)c(C)cc3c2)n1.Cc1cc(NO)nc(NC(=O)Nc2ccc3cc(Cl)c(C)cc3c2)n1.Cc1ccc2cc(NC(=O)Nc3nc(C)cc(N)n3)ccc2c1.Cc1ccc2cc(NC(=O)Nc3nc(C)cc(NCCCN(C)C)n3)ccc2c1.Cc1ccc2cc(NC(=O)Nc3nc(C)cc(NO)n3)ccc2c1
InChIInChI=1S/C22H27ClN6O.C22H28N6O.C18H18ClN5O2.C18H19N5O2.C17H16ClN5O2.C17H16ClN5O.C17H17N5O2.C17H17N5O/c1-14-10-17-12-18(7-6-16(17)13-19(14)23)26-22(30)28-21-25-15(2)11-20(27-21)24-8-5-9-29(3)4;1-15-6-7-18-14-19(9-8-17(18)12-15)25-22(29)27-21-24-16(2)13-20(26-21)23-10-5-11-28(3)4;1-10-6-13-8-14(5-4-12(13)9-15(10)19)21-18(25)23-17-20-11(2)7-16(22-17)24-26-3;1-11-4-5-14-10-15(7-6-13(14)8-11)20-18(24)22-17-19-12(2)9-16(21-17)23-25-3;1-9-5-12-7-13(4-3-11(12)8-14(9)18)20-17(24)22-16-19-10(2)6-15(21-16)23-25;1-9-5-12-7-13(4-3-11(12)8-14(9)18)21-17(24)23-16-20-10(2)6-15(19)22-16;1-10-3-4-13-9-14(6-5-12(13)7-10)19-17(23)21-16-18-11(2)8-15(20-16)22-24;1-10-3-4-13-9-14(6-5-12(13)7-10)20-17(23)22-16-19-11(2)8-15(18)21-16/h6-7,10-13H,5,8-9H2,1-4H3,(H3,24,25,26,27,28,30);6-9,12-14H,5,10-11H2,1-4H3,(H3,23,24,25,26,27,29);4-9H,1-3H3,(H3,20,21,22,23,24,25);4-10H,1-3H3,(H3,19,20,21,22,23,24);3-8,25H,1-2H3,(H3,19,20,21,22,23,24);3-8H,1-2H3,(H4,19,20,21,22,23,24);3-9,24H,1-2H3,(H3,18,19,20,21,22,23);3-9H,1-2H3,(H4,18,19,20,21,22,23)
InChIKeyGTISJOLZSRPSAE-UHFFFAOYSA-N
XLogP33.18
TPSA724.90 Ų
H-Bond Donors26
H-Bond Acceptors38
Rotatable Bonds32
Heavy Atoms206
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002858.99
LogP ≤ 533.18
H-Bond Donors ≤ 526
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

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

Analyze 1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea with MolForge

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Related Compounds

1-[4-Amino-6-(trifluoromethyl)pyrimidin-2-yl]-3-(3-chloro-4-methylphenyl)urea;1-[4-amino-6-(trifluoromethyl)pyrimidin-2-yl]-3-(4-methylphenyl)urea;1-(3-chloro-4-methylphenyl)-3-[4-[3-(dimethylamino)propylamino]-6-(trifluoromethyl)pyrimidin-2-yl]urea;1-(3-chloro-4-methylphenyl)-3-[4-(hydroxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]urea;1-(3-chloro-4-methylphenyl)-3-[4-(methoxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-(trifluoromethyl)pyrimidin-2-yl]-3-(4-methylphenyl)urea;1-[4-(hydroxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]-3-(4-methylphenyl)urea;1-[4-(methoxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]-3-(4-methylphenyl)urea
CID 159714738
1-[4-Amino-6-(trifluoromethyl)pyrimidin-2-yl]-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-[4-amino-6-(trifluoromethyl)pyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-(trifluoromethyl)pyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-(trifluoromethyl)pyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea
CID 161320483
1-[4-Amino-6-(trifluoromethyl)pyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-amino-6-(trifluoromethyl)pyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-[3-(dimethylamino)propylamino]-6-(trifluoromethyl)pyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-[3-(dimethylamino)propylamino]-6-(trifluoromethyl)pyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]-3-naphthalen-2-ylurea
CID 161921835
1-[4-Amino-6-(trifluoromethyl)pyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-amino-6-(trifluoromethyl)pyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea;1-[4-[3-(dimethylamino)propylamino]-6-(trifluoromethyl)pyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-[3-(dimethylamino)propylamino]-6-(trifluoromethyl)pyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-(trifluoromethyl)pyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea
CID 162230978
1-[4-(Hydroxyamino)-6-propan-2-ylpyrimidin-2-yl]-3-[7-[[methyl-[3-[[2-(naphthalen-2-ylcarbamoylamino)-6-propan-2-ylpyrimidin-4-yl]amino]propyl]amino]methyl]naphthalen-2-yl]urea
CID 142295476
1-(4-Amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(7-methylnaphthalen-2-yl)urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea
CID 157970749
1-(4-Amino-5-fluoro-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(4-amino-5-fluoro-6-methylpyrimidin-2-yl)-3-naphthalen-2-ylurea;1-[4-[3-(dimethylamino)propylamino]-5-fluoro-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-[3-(dimethylamino)propylamino]-5-fluoro-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[5-fluoro-4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[5-fluoro-4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[5-fluoro-4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[5-fluoro-4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea
CID 158071566
1-[4-(2-aminoethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-(4-amino-6-methylpyrimidin-2-yl)-3-naphthalen-2-ylurea;1-[4-(3-aminopropylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-[2-(dimethylamino)ethylamino]-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;N-methyl-3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propanamide
CID 158088712
1-(6-Chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea
CID 158359970
1-(6-Chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea
CID 158359971
1-(6-Chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea
CID 158359972
1-(4-Amino-5-fluoro-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-5-fluoro-6-methylpyrimidin-2-yl)-3-(7-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-5-fluoro-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[5-fluoro-4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[5-fluoro-4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-5-fluoro-6-methylpyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea;1-[5-fluoro-4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea;1-[5-fluoro-4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(7-methylnaphthalen-2-yl)urea
CID 159678854

Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea?
The IUPAC name of 1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea (CID 158359968) is 1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea.
What is the SMILES notation for 1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea?
The canonical SMILES for 1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea is CONc1cc(C)nc(NC(=O)Nc2ccc3cc(C)ccc3c2)n1.CONc1cc(C)nc(NC(=O)Nc2ccc3cc(Cl)c(C)cc3c2)n1.Cc1cc(N)nc(NC(=O)Nc2ccc3cc(Cl)c(C)cc3c2)n1.Cc1cc(NCCCN(C)C)nc(NC(=O)Nc2ccc3cc(Cl)c(C)cc3c2)n1.Cc1cc(NO)nc(NC(=O)Nc2ccc3cc(Cl)c(C)cc3c2)n1.Cc1ccc2cc(NC(=O)Nc3nc(C)cc(N)n3)ccc2c1.Cc1ccc2cc(NC(=O)Nc3nc(C)cc(NCCCN(C)C)n3)ccc2c1.Cc1ccc2cc(NC(=O)Nc3nc(C)cc(NO)n3)ccc2c1.
What is the InChIKey of 1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea?
The InChIKey is GTISJOLZSRPSAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27ClN6O.C22H28N6O.C18H18ClN5O2.C18H19N5O2.C17H16ClN5O2.C17H16ClN5O.C17H17N5O2.C17H17N5O/c1-14-10-17-12-18(7-6-16(17)13-19(14)23)26-22(30)28-21-25-15(2)11-20(27-21)24-8-5-9-29(3)4;1-15-6-7-18-14-19(9-8-17(18)12-15)25-22(29)27-21-24-16(2)13-20(26-21)23-10-5-11-28(3)4;1-10-6-13-8-14(5-4-12(13)9-15(10)19)21-18(25)23-17-20-11(2)7-16(22-17)24-26-3;1-11-4-5-14-10-15(7-6-13(14)8-11)20-18(24)22-17-19-12(2)9-16(21-17)23-25-3;1-9-5-12-7-13(4-3-11(12)8-14(9)18)20-17(24)22-16-19-10(2)6-15(21-16)23-25;1-9-5-12-7-13(4-3-11(12)8-14(9)18)21-17(24)23-16-20-10(2)6-15(19)22-16;1-10-3-4-13-9-14(6-5-12(13)7-10)19-17(23)21-16-18-11(2)8-15(20-16)22-24;1-10-3-4-13-9-14(6-5-12(13)7-10)20-17(23)22-16-19-11(2)8-15(18)21-16/h6-7,10-13H,5,8-9H2,1-4H3,(H3,24,25,26,27,28,30);6-9,12-14H,5,10-11H2,1-4H3,(H3,23,24,25,26,27,29);4-9H,1-3H3,(H3,20,21,22,23,24,25);4-10H,1-3H3,(H3,19,20,21,22,23,24);3-8,25H,1-2H3,(H3,19,20,21,22,23,24);3-8H,1-2H3,(H4,19,20,21,22,23,24);3-9,24H,1-2H3,(H3,18,19,20,21,22,23);3-9H,1-2H3,(H4,18,19,20,21,22,23).
What are the key properties of 1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea?
1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea has a molecular weight of 2858.99 g/mol, XLogP of 33.18, 32 rotatable bonds, 26 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-chloro-7-methylnaphthalen-2-yl)urea;1-(4-amino-6-methylpyrimidin-2-yl)-3-(6-methylnaphthalen-2-yl)urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]urea;1-(6-chloro-7-methylnaphthalen-2-yl)-3-[4-(methoxyamino)-6-methylpyrimidin-2-yl]urea;1-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-(6-methylnaphthalen-2-yl)urea is sourced from PubChem (CID 158359968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).