4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine

C155H169Cl4F4N31O27S4 — CID 162240783

IUPAC4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine
SMILESCc1c(Nc2ccc(S(C)(=O)=O)cc2F)ncnc1OC(C)C.Cc1c(Oc2ccc(-n3cncn3)cc2Cl)ncnc1OC(C)C.Cc1c(Oc2ccc(-n3cncn3)cc2F)ncnc1OC(C)C.Cc1c(Oc2ccc(S(=O)(=O)C3CC3)cc2Cl)ncnc1OC(C)C.Cc1c(Oc2ccc(S(=O)(=O)C3CC3)cc2F)ncnc1OC(C)C.Cc1c(Oc2ccc(S(C)(=O)=O)cc2Cl)ncnc1OC(C)C.Cc1ccc(Oc2ncnc(OC(C)C)c2C)c(C)n1.Cc1ncccc1Oc1ncnc(OC(C)C)c1C.[C-]#[N+]c1ccc(Oc2ncnc(OC(C)C)c2C)c(Cl)c1.[C-]#[N+]c1ccc(Oc2ncnc(OC(C)C)c2C)c(F)c1
InChIInChI=1S/C17H19ClN2O4S.C17H19FN2O4S.C16H16ClN5O2.C16H16FN5O2.C15H14ClN3O2.C15H17ClN2O4S.C15H18FN3O3S.C15H14FN3O2.C15H19N3O2.C14H17N3O2/c2*1-10(2)23-16-11(3)17(20-9-19-16)24-15-7-6-13(8-14(15)18)25(21,22)12-4-5-12;2*1-10(2)23-15-11(3)16(20-8-19-15)24-14-5-4-12(6-13(14)17)22-9-18-7-21-22;1-9(2)20-14-10(3)15(19-8-18-14)21-13-6-5-11(17-4)7-12(13)16;1-9(2)21-14-10(3)15(18-8-17-14)22-13-6-5-11(7-12(13)16)23(4,19)20;1-9(2)22-15-10(3)14(17-8-18-15)19-13-6-5-11(7-12(13)16)23(4,20)21;1-9(2)20-14-10(3)15(19-8-18-14)21-13-6-5-11(17-4)7-12(13)16;1-9(2)19-14-11(4)15(17-8-16-14)20-13-7-6-10(3)18-12(13)5;1-9(2)18-13-10(3)14(17-8-16-13)19-12-6-5-7-15-11(12)4/h2*6-10,12H,4-5H2,1-3H3;2*4-10H,1-3H3;5-9H,1-3H3;5-9H,1-4H3;5-9H,1-4H3,(H,17,18,19);5-9H,1-3H3;6-9H,1-5H3;5-9H,1-4H3
InChIKeyZWRCVVHOQKGBIP-UHFFFAOYSA-N
MW3244.32 g/mol
LogP35.42
Rot. Bonds48

About 4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine

4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine (PubChem CID 162240783) has the molecular formula C155H169Cl4F4N31O27S4 and a molecular weight of 3244.32 g/mol. Its IUPAC name is 4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine.

Molecular Properties

Compound Name4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine
PubChem CID162240783
Molecular FormulaC155H169Cl4F4N31O27S4
Molecular Weight3244.32 g/mol
Exact Mass3240.04
IUPAC Name4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine
SMILESCc1c(Nc2ccc(S(C)(=O)=O)cc2F)ncnc1OC(C)C.Cc1c(Oc2ccc(-n3cncn3)cc2Cl)ncnc1OC(C)C.Cc1c(Oc2ccc(-n3cncn3)cc2F)ncnc1OC(C)C.Cc1c(Oc2ccc(S(=O)(=O)C3CC3)cc2Cl)ncnc1OC(C)C.Cc1c(Oc2ccc(S(=O)(=O)C3CC3)cc2F)ncnc1OC(C)C.Cc1c(Oc2ccc(S(C)(=O)=O)cc2Cl)ncnc1OC(C)C.Cc1ccc(Oc2ncnc(OC(C)C)c2C)c(C)n1.Cc1ncccc1Oc1ncnc(OC(C)C)c1C.[C-]#[N+]c1ccc(Oc2ncnc(OC(C)C)c2C)c(Cl)c1.[C-]#[N+]c1ccc(Oc2ncnc(OC(C)C)c2C)c(F)c1
InChIInChI=1S/C17H19ClN2O4S.C17H19FN2O4S.C16H16ClN5O2.C16H16FN5O2.C15H14ClN3O2.C15H17ClN2O4S.C15H18FN3O3S.C15H14FN3O2.C15H19N3O2.C14H17N3O2/c2*1-10(2)23-16-11(3)17(20-9-19-16)24-15-7-6-13(8-14(15)18)25(21,22)12-4-5-12;2*1-10(2)23-15-11(3)16(20-8-19-15)24-14-5-4-12(6-13(14)17)22-9-18-7-21-22;1-9(2)20-14-10(3)15(19-8-18-14)21-13-6-5-11(17-4)7-12(13)16;1-9(2)21-14-10(3)15(18-8-17-14)22-13-6-5-11(7-12(13)16)23(4,19)20;1-9(2)22-15-10(3)14(17-8-18-15)19-13-6-5-11(7-12(13)16)23(4,20)21;1-9(2)20-14-10(3)15(19-8-18-14)21-13-6-5-11(17-4)7-12(13)16;1-9(2)19-14-11(4)15(17-8-16-14)20-13-7-6-10(3)18-12(13)5;1-9(2)18-13-10(3)14(17-8-16-13)19-12-6-5-7-15-11(12)4/h2*6-10,12H,4-5H2,1-3H3;2*4-10H,1-3H3;5-9H,1-3H3;5-9H,1-4H3;5-9H,1-4H3,(H,17,18,19);5-9H,1-3H3;6-9H,1-5H3;5-9H,1-4H3
InChIKeyZWRCVVHOQKGBIP-UHFFFAOYSA-N
XLogP35.42
TPSA677.68 Ų
H-Bond Donors1
H-Bond Acceptors56
Rotatable Bonds48
Heavy Atoms225
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003244.32
LogP ≤ 535.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1056

Computed Properties (RDKit)

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

Analyze 4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine?
The IUPAC name of 4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine (CID 162240783) is 4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine.
What is the SMILES notation for 4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine?
The canonical SMILES for 4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine is Cc1c(Nc2ccc(S(C)(=O)=O)cc2F)ncnc1OC(C)C.Cc1c(Oc2ccc(-n3cncn3)cc2Cl)ncnc1OC(C)C.Cc1c(Oc2ccc(-n3cncn3)cc2F)ncnc1OC(C)C.Cc1c(Oc2ccc(S(=O)(=O)C3CC3)cc2Cl)ncnc1OC(C)C.Cc1c(Oc2ccc(S(=O)(=O)C3CC3)cc2F)ncnc1OC(C)C.Cc1c(Oc2ccc(S(C)(=O)=O)cc2Cl)ncnc1OC(C)C.Cc1ccc(Oc2ncnc(OC(C)C)c2C)c(C)n1.Cc1ncccc1Oc1ncnc(OC(C)C)c1C.[C-]#[N+]c1ccc(Oc2ncnc(OC(C)C)c2C)c(Cl)c1.[C-]#[N+]c1ccc(Oc2ncnc(OC(C)C)c2C)c(F)c1.
What is the InChIKey of 4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine?
The InChIKey is ZWRCVVHOQKGBIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O4S.C17H19FN2O4S.C16H16ClN5O2.C16H16FN5O2.C15H14ClN3O2.C15H17ClN2O4S.C15H18FN3O3S.C15H14FN3O2.C15H19N3O2.C14H17N3O2/c2*1-10(2)23-16-11(3)17(20-9-19-16)24-15-7-6-13(8-14(15)18)25(21,22)12-4-5-12;2*1-10(2)23-15-11(3)16(20-8-19-15)24-14-5-4-12(6-13(14)17)22-9-18-7-21-22;1-9(2)20-14-10(3)15(19-8-18-14)21-13-6-5-11(17-4)7-12(13)16;1-9(2)21-14-10(3)15(18-8-17-14)22-13-6-5-11(7-12(13)16)23(4,19)20;1-9(2)22-15-10(3)14(17-8-18-15)19-13-6-5-11(7-12(13)16)23(4,20)21;1-9(2)20-14-10(3)15(19-8-18-14)21-13-6-5-11(17-4)7-12(13)16;1-9(2)19-14-11(4)15(17-8-16-14)20-13-7-6-10(3)18-12(13)5;1-9(2)18-13-10(3)14(17-8-16-13)19-12-6-5-7-15-11(12)4/h2*6-10,12H,4-5H2,1-3H3;2*4-10H,1-3H3;5-9H,1-3H3;5-9H,1-4H3;5-9H,1-4H3,(H,17,18,19);5-9H,1-3H3;6-9H,1-5H3;5-9H,1-4H3.
What are the key properties of 4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine?
4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine has a molecular weight of 3244.32 g/mol, XLogP of 35.42, 48 rotatable bonds, 1 hydrogen bond donors, and 56 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chloro-4-cyclopropylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-(2-chloro-4-methylsulfonylphenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[2-chloro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(4-cyclopropylsulfonyl-2-fluorophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;4-[(2,6-dimethyl-3-pyridinyl)oxy]-5-methyl-6-propan-2-yloxypyrimidine;4-(2-fluoro-4-isocyanophenoxy)-5-methyl-6-propan-2-yloxypyrimidine;N-(2-fluoro-4-methylsulfonylphenyl)-5-methyl-6-propan-2-yloxypyrimidin-4-amine;4-[2-fluoro-4-(1,2,4-triazol-1-yl)phenoxy]-5-methyl-6-propan-2-yloxypyrimidine;5-methyl-4-[(2-methyl-3-pyridinyl)oxy]-6-propan-2-yloxypyrimidine is sourced from PubChem (CID 162240783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).