4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine

C94H91Cl11N26O16S6 — CID 161309570

About 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine

4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine (PubChem CID 161309570) has the molecular formula C94H91Cl11N26O16S6 and a molecular weight of 2423.31 g/mol. Its IUPAC name is 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine.

Molecular Properties

• Compound Name: 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine
• PubChem CID: 161309570
• Molecular Formula: C94H91Cl11N26O16S6
• Molecular Weight: 2423.31 g/mol
• Exact Mass: 2416.20
• IUPAC Name: 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine
• SMILES: CCCCNS(=O)(=O)Nc1ncnc(Cl)c1-c1ccc(Cl)cc1.CCNS(=O)(=O)Nc1ncnc(Cl)c1-c1ccc(Cl)cc1.CN(Cc1ccccc1)S(=O)(=O)Nc1ncnc(Cl)c1-c1ccc(Cl)cc1.COc1ccc(Cl)c(Oc2c(Cl)ncnc2NS(=O)(=O)NCc2ccccn2)c1.COc1ccccc1Oc1c(Cl)nc(-c2ccncc2)nc1NS(=O)(=O)NC1CC1.O=S(=O)(NCC1CC1)Nc1ncnc(Cl)c1-c1ccc(Cl)cc1
• InChI: InChI=1S/C19H18ClN5O4S.C18H16Cl2N4O2S.C17H15Cl2N5O4S.C14H14Cl2N4O2S.C14H16Cl2N4O2S.C12H12Cl2N4O2S/c1-28-14-4-2-3-5-15(14)29-16-17(20)22-18(12-8-10-21-11-9-12)23-19(16)25-30(26,27)24-13-6-7-13;1-24(11-13-5-3-2-4-6-13)27(25,26)23-18-16(17(20)21-12-22-18)14-7-9-15(19)10-8-14;1-27-12-5-6-13(18)14(8-12)28-15-16(19)21-10-22-17(15)24-29(25,26)23-9-11-4-2-3-7-20-11;15-11-5-3-10(4-6-11)12-13(16)17-8-18-14(12)20-23(21,22)19-7-9-1-2-9;1-2-3-8-19-23(21,22)20-14-12(13(16)17-9-18-14)10-4-6-11(15)7-5-10;1-2-17-21(19,20)18-12-10(11(14)15-7-16-12)8-3-5-9(13)6-4-8/h2-5,8-11,13,24H,6-7H2,1H3,(H,22,23,25);2-10,12H,11H2,1H3,(H,21,22,23);2-8,10,23H,9H2,1H3,(H,21,22,24);3-6,8-9,19H,1-2,7H2,(H,17,18,20);4-7,9,19H,2-3,8H2,1H3,(H,17,18,20);3-7,17H,2H2,1H3,(H,15,16,18)
• InChIKey: VIRYOZHROLXWMN-UHFFFAOYSA-N
• XLogP: 20.39
• TPSA: 557.79 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 30
• Rotatable Bonds: 40
• Heavy Atoms: 153
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2423.31
LogP ≤ 5	20.39
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine?

The IUPAC name of 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine (CID 161309570) is 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine.

What is the SMILES notation for 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine?

The canonical SMILES for 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine is CCCCNS(=O)(=O)Nc1ncnc(Cl)c1-c1ccc(Cl)cc1.CCNS(=O)(=O)Nc1ncnc(Cl)c1-c1ccc(Cl)cc1.CN(Cc1ccccc1)S(=O)(=O)Nc1ncnc(Cl)c1-c1ccc(Cl)cc1.COc1ccc(Cl)c(Oc2c(Cl)ncnc2NS(=O)(=O)NCc2ccccn2)c1.COc1ccccc1Oc1c(Cl)nc(-c2ccncc2)nc1NS(=O)(=O)NC1CC1.O=S(=O)(NCC1CC1)Nc1ncnc(Cl)c1-c1ccc(Cl)cc1.

What is the InChIKey of 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine?

The InChIKey is VIRYOZHROLXWMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN5O4S.C18H16Cl2N4O2S.C17H15Cl2N5O4S.C14H14Cl2N4O2S.C14H16Cl2N4O2S.C12H12Cl2N4O2S/c1-28-14-4-2-3-5-15(14)29-16-17(20)22-18(12-8-10-21-11-9-12)23-19(16)25-30(26,27)24-13-6-7-13;1-24(11-13-5-3-2-4-6-13)27(25,26)23-18-16(17(20)21-12-22-18)14-7-9-15(19)10-8-14;1-27-12-5-6-13(18)14(8-12)28-15-16(19)21-10-22-17(15)24-29(25,26)23-9-11-4-2-3-7-20-11;15-11-5-3-10(4-6-11)12-13(16)17-8-18-14(12)20-23(21,22)19-7-9-1-2-9;1-2-3-8-19-23(21,22)20-14-12(13(16)17-9-18-14)10-4-6-11(15)7-5-10;1-2-17-21(19,20)18-12-10(11(14)15-7-16-12)8-3-5-9(13)6-4-8/h2-5,8-11,13,24H,6-7H2,1H3,(H,22,23,25);2-10,12H,11H2,1H3,(H,21,22,23);2-8,10,23H,9H2,1H3,(H,21,22,24);3-6,8-9,19H,1-2,7H2,(H,17,18,20);4-7,9,19H,2-3,8H2,1H3,(H,17,18,20);3-7,17H,2H2,1H3,(H,15,16,18).

What are the key properties of 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine?

4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine has a molecular weight of 2423.31 g/mol, XLogP of 20.39, 40 rotatable bonds, 11 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(4-chlorophenyl)pyrimidine;N-(butylsulfamoyl)-6-chloro-5-(4-chlorophenyl)pyrimidin-4-amine;6-chloro-5-(2-chloro-5-methoxyphenoxy)-N-(pyridin-2-ylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(cyclopropylmethylsulfamoyl)pyrimidin-4-amine;6-chloro-5-(4-chlorophenyl)-N-(ethylsulfamoyl)pyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 161309570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).