4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide

C127H126Cl6FN35O25S6 — CID 158600657

About 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide

4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide (PubChem CID 158600657) has the molecular formula C127H126Cl6FN35O25S6 and a molecular weight of 2966.74 g/mol. Its IUPAC name is 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide.

Molecular Properties

• Compound Name: 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide
• PubChem CID: 158600657
• Molecular Formula: C127H126Cl6FN35O25S6
• Molecular Weight: 2966.74 g/mol
• Exact Mass: 2961.61
• IUPAC Name: 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide
• SMILES: COc1ccccc1Oc1c(Cl)nc(-c2ccncc2)nc1NS(=O)(=O)NCC1CCCCC1.COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1NS(=O)(=O)N(C)Cc1ccccc1.COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1NS(=O)(=O)N1CCOCC1.COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1NS(=O)(=O)NC1CC1.COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1NS(=O)(=O)NCC1CCCCC1.COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1NS(=O)(=O)NCc1ccc(F)cc1
• InChI: InChI=1S/C23H21ClN6O4S.C23H26ClN5O4S.C22H18ClFN6O4S.C22H25ClN6O4S.C19H19ClN6O5S.C18H17ClN6O4S/c1-30(15-16-9-4-3-5-10-16)35(31,32)29-21-19(34-18-12-7-6-11-17(18)33-2)20(24)27-23(28-21)22-25-13-8-14-26-22;1-32-18-9-5-6-10-19(18)33-20-21(24)27-22(17-11-13-25-14-12-17)28-23(20)29-34(30,31)26-15-16-7-3-2-4-8-16;1-33-16-5-2-3-6-17(16)34-18-19(23)28-22(21-25-11-4-12-26-21)29-20(18)30-35(31,32)27-13-14-7-9-15(24)10-8-14;1-32-16-10-5-6-11-17(16)33-18-19(23)27-22(21-24-12-7-13-25-21)28-20(18)29-34(30,31)26-14-15-8-3-2-4-9-15;1-29-13-5-2-3-6-14(13)31-15-16(20)23-19(18-21-7-4-8-22-18)24-17(15)25-32(27,28)26-9-11-30-12-10-26;1-28-12-5-2-3-6-13(12)29-14-15(19)22-18(17-20-9-4-10-21-17)23-16(14)25-30(26,27)24-11-7-8-11/h3-14H,15H2,1-2H3,(H,27,28,29);5-6,9-14,16,26H,2-4,7-8,15H2,1H3,(H,27,28,29);2-12,27H,13H2,1H3,(H,28,29,30);5-7,10-13,15,26H,2-4,8-9,14H2,1H3,(H,27,28,29);2-8H,9-12H2,1H3,(H,23,24,25);2-6,9-11,24H,7-8H2,1H3,(H,22,23,25)
• InChIKey: HVOZPLIWPWOMAP-UHFFFAOYSA-N
• XLogP: 22.36
• TPSA: 748.08 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 48
• Rotatable Bonds: 51
• Heavy Atoms: 200
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2966.74
LogP ≤ 5	22.36
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	48

Frequently Asked Questions

What is the IUPAC name of 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide?

The IUPAC name of 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide (CID 158600657) is 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide.

What is the SMILES notation for 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide?

The canonical SMILES for 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide is COc1ccccc1Oc1c(Cl)nc(-c2ccncc2)nc1NS(=O)(=O)NCC1CCCCC1.COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1NS(=O)(=O)N(C)Cc1ccccc1.COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1NS(=O)(=O)N1CCOCC1.COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1NS(=O)(=O)NC1CC1.COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1NS(=O)(=O)NCC1CCCCC1.COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1NS(=O)(=O)NCc1ccc(F)cc1.

What is the InChIKey of 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide?

The InChIKey is HVOZPLIWPWOMAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21ClN6O4S.C23H26ClN5O4S.C22H18ClFN6O4S.C22H25ClN6O4S.C19H19ClN6O5S.C18H17ClN6O4S/c1-30(15-16-9-4-3-5-10-16)35(31,32)29-21-19(34-18-12-7-6-11-17(18)33-2)20(24)27-23(28-21)22-25-13-8-14-26-22;1-32-18-9-5-6-10-19(18)33-20-21(24)27-22(17-11-13-25-14-12-17)28-23(20)29-34(30,31)26-15-16-7-3-2-4-8-16;1-33-16-5-2-3-6-17(16)34-18-19(23)28-22(21-25-11-4-12-26-21)29-20(18)30-35(31,32)27-13-14-7-9-15(24)10-8-14;1-32-16-10-5-6-11-17(16)33-18-19(23)27-22(21-24-12-7-13-25-21)28-20(18)29-34(30,31)26-14-15-8-3-2-4-9-15;1-29-13-5-2-3-6-14(13)31-15-16(20)23-19(18-21-7-4-8-22-18)24-17(15)25-32(27,28)26-9-11-30-12-10-26;1-28-12-5-2-3-6-13(12)29-14-15(19)22-18(17-20-9-4-10-21-17)23-16(14)25-30(26,27)24-11-7-8-11/h3-14H,15H2,1-2H3,(H,27,28,29);5-6,9-14,16,26H,2-4,7-8,15H2,1H3,(H,27,28,29);2-12,27H,13H2,1H3,(H,28,29,30);5-7,10-13,15,26H,2-4,8-9,14H2,1H3,(H,27,28,29);2-8H,9-12H2,1H3,(H,23,24,25);2-6,9-11,24H,7-8H2,1H3,(H,22,23,25).

What are the key properties of 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide?

4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide has a molecular weight of 2966.74 g/mol, XLogP of 22.36, 51 rotatable bonds, 10 hydrogen bond donors, and 48 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[[benzyl(methyl)sulfamoyl]amino]-6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyridin-4-ylpyrimidin-4-amine;6-chloro-N-(cyclohexylmethylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-(cyclopropylsulfamoyl)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;6-chloro-N-[(4-fluorophenyl)methylsulfamoyl]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-amine;N-[6-chloro-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]morpholine-4-sulfonamide is sourced from PubChem (CID 158600657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).