N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide

C121H89Cl5F17N31O13S5 — CID 162077032

IUPACN-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide
SMILESCC(CC(=O)c1cc(-c2ccc(N3CCOCC3)nc2)ncn1)c1ncc(C(=O)Nc2cc(C(F)(F)F)c(Cl)cn2)s1.CC(CC(=O)c1cc(-c2ccnc(F)c2)ncn1)c1ncc(C(=O)Nc2cc(C(F)(F)F)c(Cl)cn2)s1.CC(CC(=O)c1cc(-c2cncc(F)c2)ncn1)c1ncc(C(=O)Nc2cc(C(F)(F)F)c(Cl)cn2)s1.COc1ccncc1-c1cc(C(=O)CC(C)c2ncc(C(=O)Nc3cc(C(F)(F)F)c(Cl)cn3)s2)ncn1.COc1cncc(-c2cc(C(=O)CC(C)c3ncc(C(=O)Nc4cc(C(F)(F)F)c(Cl)cn4)s3)ncn2)c1
InChIInChI=1S/C27H23ClF3N7O3S.2C24H18ClF3N6O3S.2C23H15ClF4N6O2S/c1-15(26-34-13-22(42-26)25(40)37-23-9-17(27(29,30)31)18(28)12-32-23)8-21(39)20-10-19(35-14-36-20)16-2-3-24(33-11-16)38-4-6-41-7-5-38;1-12(3-19(35)18-6-17(32-11-33-18)13-4-14(37-2)8-29-7-13)23-31-10-20(38-23)22(36)34-21-5-15(24(26,27)28)16(25)9-30-21;1-12(5-18(35)17-7-16(32-11-33-17)13-8-29-4-3-19(13)37-2)23-31-10-20(38-23)22(36)34-21-6-14(24(26,27)28)15(25)9-30-21;1-11(2-18(35)17-5-16(32-10-33-17)12-3-13(25)7-29-6-12)22-31-9-19(37-22)21(36)34-20-4-14(23(26,27)28)15(24)8-30-20;1-11(4-17(35)16-7-15(32-10-33-16)12-2-3-29-19(25)5-12)22-31-9-18(37-22)21(36)34-20-6-13(23(26,27)28)14(24)8-30-20/h2-3,9-15H,4-8H2,1H3,(H,32,37,40);4-12H,3H2,1-2H3,(H,30,34,36);3-4,6-12H,5H2,1-2H3,(H,30,34,36);3-11H,2H2,1H3,(H,30,34,36);2-3,5-11H,4H2,1H3,(H,30,34,36)
InChIKeyZBVLZBXUXMIKTL-UHFFFAOYSA-N
MW2845.81 g/mol
LogP28.59
Rot. Bonds38

About N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide

N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide (PubChem CID 162077032) has the molecular formula C121H89Cl5F17N31O13S5 and a molecular weight of 2845.81 g/mol. Its IUPAC name is N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide
PubChem CID162077032
Molecular FormulaC121H89Cl5F17N31O13S5
Molecular Weight2845.81 g/mol
Exact Mass2841.40
IUPAC NameN-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide
SMILESCC(CC(=O)c1cc(-c2ccc(N3CCOCC3)nc2)ncn1)c1ncc(C(=O)Nc2cc(C(F)(F)F)c(Cl)cn2)s1.CC(CC(=O)c1cc(-c2ccnc(F)c2)ncn1)c1ncc(C(=O)Nc2cc(C(F)(F)F)c(Cl)cn2)s1.CC(CC(=O)c1cc(-c2cncc(F)c2)ncn1)c1ncc(C(=O)Nc2cc(C(F)(F)F)c(Cl)cn2)s1.COc1ccncc1-c1cc(C(=O)CC(C)c2ncc(C(=O)Nc3cc(C(F)(F)F)c(Cl)cn3)s2)ncn1.COc1cncc(-c2cc(C(=O)CC(C)c3ncc(C(=O)Nc4cc(C(F)(F)F)c(Cl)cn4)s3)ncn2)c1
InChIInChI=1S/C27H23ClF3N7O3S.2C24H18ClF3N6O3S.2C23H15ClF4N6O2S/c1-15(26-34-13-22(42-26)25(40)37-23-9-17(27(29,30)31)18(28)12-32-23)8-21(39)20-10-19(35-14-36-20)16-2-3-24(33-11-16)38-4-6-41-7-5-38;1-12(3-19(35)18-6-17(32-11-33-18)13-4-14(37-2)8-29-7-13)23-31-10-20(38-23)22(36)34-21-5-15(24(26,27)28)16(25)9-30-21;1-12(5-18(35)17-7-16(32-11-33-17)13-8-29-4-3-19(13)37-2)23-31-10-20(38-23)22(36)34-21-6-14(24(26,27)28)15(25)9-30-21;1-11(2-18(35)17-5-16(32-10-33-17)12-3-13(25)7-29-6-12)22-31-9-19(37-22)21(36)34-20-4-14(23(26,27)28)15(24)8-30-20;1-11(4-17(35)16-7-15(32-10-33-16)12-2-3-29-19(25)5-12)22-31-9-18(37-22)21(36)34-20-6-13(23(26,27)28)14(24)8-30-20/h2-3,9-15H,4-8H2,1H3,(H,32,37,40);4-12H,3H2,1-2H3,(H,30,34,36);3-4,6-12H,5H2,1-2H3,(H,30,34,36);3-11H,2H2,1H3,(H,30,34,36);2-3,5-11H,4H2,1H3,(H,30,34,36)
InChIKeyZBVLZBXUXMIKTL-UHFFFAOYSA-N
XLogP28.59
TPSA584.03 Ų
H-Bond Donors5
H-Bond Acceptors44
Rotatable Bonds38
Heavy Atoms192
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002845.81
LogP ≤ 528.59
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1044

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide?
The IUPAC name of N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide (CID 162077032) is N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide is CC(CC(=O)c1cc(-c2ccc(N3CCOCC3)nc2)ncn1)c1ncc(C(=O)Nc2cc(C(F)(F)F)c(Cl)cn2)s1.CC(CC(=O)c1cc(-c2ccnc(F)c2)ncn1)c1ncc(C(=O)Nc2cc(C(F)(F)F)c(Cl)cn2)s1.CC(CC(=O)c1cc(-c2cncc(F)c2)ncn1)c1ncc(C(=O)Nc2cc(C(F)(F)F)c(Cl)cn2)s1.COc1ccncc1-c1cc(C(=O)CC(C)c2ncc(C(=O)Nc3cc(C(F)(F)F)c(Cl)cn3)s2)ncn1.COc1cncc(-c2cc(C(=O)CC(C)c3ncc(C(=O)Nc4cc(C(F)(F)F)c(Cl)cn4)s3)ncn2)c1.
What is the InChIKey of N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide?
The InChIKey is ZBVLZBXUXMIKTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23ClF3N7O3S.2C24H18ClF3N6O3S.2C23H15ClF4N6O2S/c1-15(26-34-13-22(42-26)25(40)37-23-9-17(27(29,30)31)18(28)12-32-23)8-21(39)20-10-19(35-14-36-20)16-2-3-24(33-11-16)38-4-6-41-7-5-38;1-12(3-19(35)18-6-17(32-11-33-18)13-4-14(37-2)8-29-7-13)23-31-10-20(38-23)22(36)34-21-5-15(24(26,27)28)16(25)9-30-21;1-12(5-18(35)17-7-16(32-11-33-17)13-8-29-4-3-19(13)37-2)23-31-10-20(38-23)22(36)34-21-6-14(24(26,27)28)15(25)9-30-21;1-11(2-18(35)17-5-16(32-10-33-17)12-3-13(25)7-29-6-12)22-31-9-19(37-22)21(36)34-20-4-14(23(26,27)28)15(24)8-30-20;1-11(4-17(35)16-7-15(32-10-33-16)12-2-3-29-19(25)5-12)22-31-9-18(37-22)21(36)34-20-6-13(23(26,27)28)14(24)8-30-20/h2-3,9-15H,4-8H2,1H3,(H,32,37,40);4-12H,3H2,1-2H3,(H,30,34,36);3-4,6-12H,5H2,1-2H3,(H,30,34,36);3-11H,2H2,1H3,(H,30,34,36);2-3,5-11H,4H2,1H3,(H,30,34,36).
What are the key properties of N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide?
N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide has a molecular weight of 2845.81 g/mol, XLogP of 28.59, 38 rotatable bonds, 5 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(2-fluoro-4-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-fluoro-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(4-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(5-methoxy-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-[4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-yl]-4-oxobutan-2-yl]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 162077032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).