3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile

C124H127Cl5F6N30O14S — CID 161369962

IUPAC3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile
SMILESCC(C)(C)Oc1cc(Nc2ccc(C#N)cc2Cl)ncn1.CC(C)(C)Oc1cc(Nc2ccc(C#N)cc2F)ncn1.CC(C)(C)Oc1ncnc(Nc2ccc(C#N)cc2F)c1Cl.CC(C)(C)Oc1ncnc(Nc2ccc(S(C)(=O)=O)cc2F)c1F.COc1c(Nc2c(F)cc(C#N)cc2Cl)ncnc1OC(C)(C)C.COc1c(Nc2ccc(C#N)cc2Cl)ncnc1OC(C)(C)C.COc1c(Nc2ccc(C#N)cc2F)ncnc1OC(C)(C)C.Cc1c(Oc2ccc(C#N)cc2Cl)ncnc1OC(C)(C)C
InChIInChI=1S/C16H16ClFN4O2.C16H17ClN4O2.C16H16ClN3O2.C16H17FN4O2.C15H14ClFN4O.C15H15ClN4O.C15H17F2N3O3S.C15H15FN4O/c1-16(2,3)24-15-13(23-4)14(20-8-21-15)22-12-10(17)5-9(7-19)6-11(12)18;1-16(2,3)23-15-13(22-4)14(19-9-20-15)21-12-6-5-10(8-18)7-11(12)17;1-10-14(19-9-20-15(10)22-16(2,3)4)21-13-6-5-11(8-18)7-12(13)17;1-16(2,3)23-15-13(22-4)14(19-9-20-15)21-12-6-5-10(8-18)7-11(12)17;1-15(2,3)22-14-12(16)13(19-8-20-14)21-11-5-4-9(7-18)6-10(11)17;1-15(2,3)21-14-7-13(18-9-19-14)20-12-5-4-10(8-17)6-11(12)16;1-15(2,3)23-14-12(17)13(18-8-19-14)20-11-6-5-9(7-10(11)16)24(4,21)22;1-15(2,3)21-14-7-13(18-9-19-14)20-12-5-4-10(8-17)6-11(12)16/h5-6,8H,1-4H3,(H,20,21,22);5-7,9H,1-4H3,(H,19,20,21);5-7,9H,1-4H3;5-7,9H,1-4H3,(H,19,20,21);4-6,8H,1-3H3,(H,19,20,21);4-7,9H,1-3H3,(H,18,19,20);5-8H,1-4H3,(H,18,19,20);4-7,9H,1-3H3,(H,18,19,20)
InChIKeyVQIGCYQIKWCYKK-UHFFFAOYSA-N
MW2584.90 g/mol
LogP30.17
Rot. Bonds28

About 3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile

3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile (PubChem CID 161369962) has the molecular formula C124H127Cl5F6N30O14S and a molecular weight of 2584.90 g/mol. Its IUPAC name is 3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile.

Molecular Properties

Compound Name3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile
PubChem CID161369962
Molecular FormulaC124H127Cl5F6N30O14S
Molecular Weight2584.90 g/mol
Exact Mass2580.82
IUPAC Name3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile
SMILESCC(C)(C)Oc1cc(Nc2ccc(C#N)cc2Cl)ncn1.CC(C)(C)Oc1cc(Nc2ccc(C#N)cc2F)ncn1.CC(C)(C)Oc1ncnc(Nc2ccc(C#N)cc2F)c1Cl.CC(C)(C)Oc1ncnc(Nc2ccc(S(C)(=O)=O)cc2F)c1F.COc1c(Nc2c(F)cc(C#N)cc2Cl)ncnc1OC(C)(C)C.COc1c(Nc2ccc(C#N)cc2Cl)ncnc1OC(C)(C)C.COc1c(Nc2ccc(C#N)cc2F)ncnc1OC(C)(C)C.Cc1c(Oc2ccc(C#N)cc2Cl)ncnc1OC(C)(C)C
InChIInChI=1S/C16H16ClFN4O2.C16H17ClN4O2.C16H16ClN3O2.C16H17FN4O2.C15H14ClFN4O.C15H15ClN4O.C15H17F2N3O3S.C15H15FN4O/c1-16(2,3)24-15-13(23-4)14(20-8-21-15)22-12-10(17)5-9(7-19)6-11(12)18;1-16(2,3)23-15-13(22-4)14(19-9-20-15)21-12-6-5-10(8-18)7-11(12)17;1-10-14(19-9-20-15(10)22-16(2,3)4)21-13-6-5-11(8-18)7-12(13)17;1-16(2,3)23-15-13(22-4)14(19-9-20-15)21-12-6-5-10(8-18)7-11(12)17;1-15(2,3)22-14-12(16)13(19-8-20-14)21-11-5-4-9(7-18)6-10(11)17;1-15(2,3)21-14-7-13(18-9-19-14)20-12-5-4-10(8-17)6-11(12)16;1-15(2,3)23-14-12(17)13(18-8-19-14)20-11-6-5-9(7-10(11)16)24(4,21)22;1-15(2,3)21-14-7-13(18-9-19-14)20-12-5-4-10(8-17)6-11(12)16/h5-6,8H,1-4H3,(H,20,21,22);5-7,9H,1-4H3,(H,19,20,21);5-7,9H,1-4H3;5-7,9H,1-4H3,(H,19,20,21);4-6,8H,1-3H3,(H,19,20,21);4-7,9H,1-3H3,(H,18,19,20);5-8H,1-4H3,(H,18,19,20);4-7,9H,1-3H3,(H,18,19,20)
InChIKeyVQIGCYQIKWCYKK-UHFFFAOYSA-N
XLogP30.17
TPSA601.88 Ų
H-Bond Donors7
H-Bond Acceptors44
Rotatable Bonds28
Heavy Atoms180
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002584.90
LogP ≤ 530.17
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1044

Analyze 3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile?
The IUPAC name of 3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile (CID 161369962) is 3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile.
What is the SMILES notation for 3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile?
The canonical SMILES for 3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile is CC(C)(C)Oc1cc(Nc2ccc(C#N)cc2Cl)ncn1.CC(C)(C)Oc1cc(Nc2ccc(C#N)cc2F)ncn1.CC(C)(C)Oc1ncnc(Nc2ccc(C#N)cc2F)c1Cl.CC(C)(C)Oc1ncnc(Nc2ccc(S(C)(=O)=O)cc2F)c1F.COc1c(Nc2c(F)cc(C#N)cc2Cl)ncnc1OC(C)(C)C.COc1c(Nc2ccc(C#N)cc2Cl)ncnc1OC(C)(C)C.COc1c(Nc2ccc(C#N)cc2F)ncnc1OC(C)(C)C.Cc1c(Oc2ccc(C#N)cc2Cl)ncnc1OC(C)(C)C.
What is the InChIKey of 3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile?
The InChIKey is VQIGCYQIKWCYKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClFN4O2.C16H17ClN4O2.C16H16ClN3O2.C16H17FN4O2.C15H14ClFN4O.C15H15ClN4O.C15H17F2N3O3S.C15H15FN4O/c1-16(2,3)24-15-13(23-4)14(20-8-21-15)22-12-10(17)5-9(7-19)6-11(12)18;1-16(2,3)23-15-13(22-4)14(19-9-20-15)21-12-6-5-10(8-18)7-11(12)17;1-10-14(19-9-20-15(10)22-16(2,3)4)21-13-6-5-11(8-18)7-12(13)17;1-16(2,3)23-15-13(22-4)14(19-9-20-15)21-12-6-5-10(8-18)7-11(12)17;1-15(2,3)22-14-12(16)13(19-8-20-14)21-11-5-4-9(7-18)6-10(11)17;1-15(2,3)21-14-7-13(18-9-19-14)20-12-5-4-10(8-17)6-11(12)16;1-15(2,3)23-14-12(17)13(18-8-19-14)20-11-6-5-9(7-10(11)16)24(4,21)22;1-15(2,3)21-14-7-13(18-9-19-14)20-12-5-4-10(8-17)6-11(12)16/h5-6,8H,1-4H3,(H,20,21,22);5-7,9H,1-4H3,(H,19,20,21);5-7,9H,1-4H3;5-7,9H,1-4H3,(H,19,20,21);4-6,8H,1-3H3,(H,19,20,21);4-7,9H,1-3H3,(H,18,19,20);5-8H,1-4H3,(H,18,19,20);4-7,9H,1-3H3,(H,18,19,20).
What are the key properties of 3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile?
3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile has a molecular weight of 2584.90 g/mol, XLogP of 30.17, 28 rotatable bonds, 7 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-chloro-4-[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]oxybenzonitrile;3-chloro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]-3-fluorobenzonitrile;5-fluoro-N-(2-fluoro-4-methylsulfonylphenyl)-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-amine;3-fluoro-4-[[5-methoxy-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile;3-fluoro-4-[[6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]amino]benzonitrile is sourced from PubChem (CID 161369962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).