3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide

C143H132ClF2N39O21 — CID 161277573

IUPAC3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide
SMILESCCc1nc2cc(C(=O)Nc3cnn(Cc4c(C)noc4C)c3)ccc2o1.Cc1cc2cc(C(=O)Nc3cnn(Cc4c(C)noc4C)c3)ccc2o1.Cc1nc2ccc(C(=O)Nc3cnn(Cc4c(C)noc4C)c3)cc2[nH]1.Cc1noc(C)c1Cn1cc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)cn1.Cc1noc(C)c1Cn1cc(NC(=O)c2ccc3nccnc3c2)cn1.Cc1noc(C)c1Cn1cc(NC(=O)c2ccc3occc3c2)cn1.Cc1noc(C)c1Cn1cc(NC(=O)c2cccc(Cl)c2)cn1.Cc1noc(C)c1Cn1cc(NC(=O)c2cccc3nccnc23)cn1
InChIInChI=1S/C19H19N5O3.C19H18N4O3.C18H18N6O2.2C18H16N6O2.C18H16N4O3.C17H14F2N4O4.C16H15ClN4O2/c1-4-18-22-16-7-13(5-6-17(16)26-18)19(25)21-14-8-20-24(9-14)10-15-11(2)23-27-12(15)3;1-11-6-15-7-14(4-5-18(15)25-11)19(24)21-16-8-20-23(9-16)10-17-12(2)22-26-13(17)3;1-10-15(11(2)26-23-10)9-24-8-14(7-19-24)22-18(25)13-4-5-16-17(6-13)21-12(3)20-16;1-11-15(12(2)26-23-11)10-24-9-14(8-21-24)22-18(25)13-3-4-16-17(7-13)20-6-5-19-16;1-11-15(12(2)26-23-11)10-24-9-13(8-21-24)22-18(25)14-4-3-5-16-17(14)20-7-6-19-16;1-11-16(12(2)25-21-11)10-22-9-15(8-19-22)20-18(23)14-3-4-17-13(7-14)5-6-24-17;1-9-13(10(2)27-22-9)8-23-7-12(6-20-23)21-16(24)11-3-4-14-15(5-11)26-17(18,19)25-14;1-10-15(11(2)23-20-10)9-21-8-14(7-18-21)19-16(22)12-4-3-5-13(17)6-12/h5-9H,4,10H2,1-3H3,(H,21,25);4-9H,10H2,1-3H3,(H,21,24);4-8H,9H2,1-3H3,(H,20,21)(H,22,25);2*3-9H,10H2,1-2H3,(H,22,25);3-9H,10H2,1-2H3,(H,20,23);3-7H,8H2,1-2H3,(H,21,24);3-8H,9H2,1-2H3,(H,19,22)
InChIKeyVEQIWQAAAMZPRP-UHFFFAOYSA-N
MW2806.33 g/mol
LogP25.86
Rot. Bonds33

About 3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide

3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide (PubChem CID 161277573) has the molecular formula C143H132ClF2N39O21 and a molecular weight of 2806.33 g/mol. Its IUPAC name is 3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide.

Molecular Properties

Compound Name3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide
PubChem CID161277573
Molecular FormulaC143H132ClF2N39O21
Molecular Weight2806.33 g/mol
Exact Mass2804.01
IUPAC Name3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide
SMILESCCc1nc2cc(C(=O)Nc3cnn(Cc4c(C)noc4C)c3)ccc2o1.Cc1cc2cc(C(=O)Nc3cnn(Cc4c(C)noc4C)c3)ccc2o1.Cc1nc2ccc(C(=O)Nc3cnn(Cc4c(C)noc4C)c3)cc2[nH]1.Cc1noc(C)c1Cn1cc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)cn1.Cc1noc(C)c1Cn1cc(NC(=O)c2ccc3nccnc3c2)cn1.Cc1noc(C)c1Cn1cc(NC(=O)c2ccc3occc3c2)cn1.Cc1noc(C)c1Cn1cc(NC(=O)c2cccc(Cl)c2)cn1.Cc1noc(C)c1Cn1cc(NC(=O)c2cccc3nccnc23)cn1
InChIInChI=1S/C19H19N5O3.C19H18N4O3.C18H18N6O2.2C18H16N6O2.C18H16N4O3.C17H14F2N4O4.C16H15ClN4O2/c1-4-18-22-16-7-13(5-6-17(16)26-18)19(25)21-14-8-20-24(9-14)10-15-11(2)23-27-12(15)3;1-11-6-15-7-14(4-5-18(15)25-11)19(24)21-16-8-20-23(9-16)10-17-12(2)22-26-13(17)3;1-10-15(11(2)26-23-10)9-24-8-14(7-19-24)22-18(25)13-4-5-16-17(6-13)21-12(3)20-16;1-11-15(12(2)26-23-11)10-24-9-14(8-21-24)22-18(25)13-3-4-16-17(7-13)20-6-5-19-16;1-11-15(12(2)26-23-11)10-24-9-13(8-21-24)22-18(25)14-4-3-5-16-17(14)20-7-6-19-16;1-11-16(12(2)25-21-11)10-22-9-15(8-19-22)20-18(23)14-3-4-17-13(7-14)5-6-24-17;1-9-13(10(2)27-22-9)8-23-7-12(6-20-23)21-16(24)11-3-4-14-15(5-11)26-17(18,19)25-14;1-10-15(11(2)23-20-10)9-21-8-14(7-18-21)19-16(22)12-4-3-5-13(17)6-12/h5-9H,4,10H2,1-3H3,(H,21,25);4-9H,10H2,1-3H3,(H,21,24);4-8H,9H2,1-3H3,(H,20,21)(H,22,25);2*3-9H,10H2,1-2H3,(H,22,25);3-9H,10H2,1-2H3,(H,20,23);3-7H,8H2,1-2H3,(H,21,24);3-8H,9H2,1-2H3,(H,19,22)
InChIKeyVEQIWQAAAMZPRP-UHFFFAOYSA-N
XLogP25.86
TPSA734.61 Ų
H-Bond Donors9
H-Bond Acceptors51
Rotatable Bonds33
Heavy Atoms206
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002806.33
LogP ≤ 525.86
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1051

Analyze 3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

4-tert-butyl-1H-benzimidazole;3-tert-butyl-1-benzothiophene;5-tert-butyl-1,3-benzoxazol-2-amine;7-tert-butyl-5-chloro-1H-indazole;7-tert-butyl-6-chloro-1H-indazole;4-tert-butyl-2,2-difluoro-1,3-benzodioxole;5-tert-butyl-2,3-dihydro-1,4-benzodioxine;4-tert-butyl-1,3-dihydroindol-2-one;5-tert-butyl-3,4-dihydro-1H-quinolin-2-one;7-tert-butyl-5,6-dimethyl-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;7-tert-butyl-1H-indazole;3-tert-butyl-1H-indole;1-tert-butylisoquinolin-3-amine;4-tert-butyl-5-methoxy-1H-indazole;4-tert-butyl-3-methyl-1,2-benzoxazole;7-tert-butyl-6-methyl-1H-indazole;6-tert-butyl-3-methyl-1H-isoindole;5-tert-butyl-1,2,3,4-tetrahydroquinoline
CID 158246934
4-tert-butyl-1H-benzimidazole;3-tert-butyl-1-benzothiophene;7-tert-butyl-5-chloro-1H-indazole;7-tert-butyl-6-chloro-1H-indazole;4-tert-butyl-2,2-difluoro-1,3-benzodioxole;5-tert-butyl-2,3-dihydro-1,4-benzodioxine;4-tert-butyl-1,3-dihydroindol-2-one;5-tert-butyl-3,4-dihydro-1H-quinolin-2-one;7-tert-butyl-5,6-dimethyl-1H-indazole;5-tert-butyl-1H-indazole;7-tert-butyl-1H-indazole;3-tert-butyl-1H-indole;6-tert-butyl-1H-isoindole;4-tert-butyl-5-methoxy-1H-indazole;4-tert-butyl-3-methyl-1,2-benzoxazole;5-tert-butyl-2-methyl-1,3-benzoxazole;7-tert-butyl-6-methyl-1H-indazole;6-tert-butyl-3-methyl-1H-isoindole;5-tert-butyl-1,2,3,4-tetrahydroquinoline
CID 158512126
3-(3-aminoazetidin-1-yl)-5-(8-chloroquinolin-6-yl)-6-(5-methylfuran-2-yl)pyrazin-2-amine;5-(7-chloro-3H-benzimidazol-5-yl)-6-(3-methylpyrazol-1-yl)-3-(oxetan-3-yl)pyrazin-2-amine;5-(4-chloro-1,3-benzoxazol-6-yl)-3-cyclohexyl-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(4-chloro-1,3-benzoxazol-6-yl)-6-(1-methylpyrazol-3-yl)-3-phenylpyrazin-2-amine;5-(7-methyl-1,2-benzoxazol-5-yl)-3-(3-methylimidazolidin-1-yl)-6-phenylpyrazin-2-amine
CID 162143247
tris(2-amino-5-methyl-N-propan-2-yl-1H-benzimidazole-4-carboxamide);4-methoxy-N-propan-2-yl-1H-indole-2-carboxamide;tris(5-methyl-N-propan-2-yl-1H-indazole-4-carboxamide);1-methyl-N-propan-2-ylindole-2-carboxamide;5-methyl-N-propan-2-yl-1,2-oxazole-3-carboxamide;4-oxo-N-propan-2-yl-1H-pyridine-2-carboxamide;bis(6-oxo-N-propan-2-yl-1H-pyridine-2-carboxamide);N-propan-2-yl-1-benzofuran-2-carboxamide;N-propan-2-yl-[1,3]dioxolo[4,5-b]pyrazine-5-carboxamide;N-propan-2-yl-1H-indole-2-carboxamide;N-propan-2-ylquinoxaline-2-carboxamide
CID 167657307

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide?
The IUPAC name of 3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide (CID 161277573) is 3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide.
What is the SMILES notation for 3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide?
The canonical SMILES for 3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide is CCc1nc2cc(C(=O)Nc3cnn(Cc4c(C)noc4C)c3)ccc2o1.Cc1cc2cc(C(=O)Nc3cnn(Cc4c(C)noc4C)c3)ccc2o1.Cc1nc2ccc(C(=O)Nc3cnn(Cc4c(C)noc4C)c3)cc2[nH]1.Cc1noc(C)c1Cn1cc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)cn1.Cc1noc(C)c1Cn1cc(NC(=O)c2ccc3nccnc3c2)cn1.Cc1noc(C)c1Cn1cc(NC(=O)c2ccc3occc3c2)cn1.Cc1noc(C)c1Cn1cc(NC(=O)c2cccc(Cl)c2)cn1.Cc1noc(C)c1Cn1cc(NC(=O)c2cccc3nccnc23)cn1.
What is the InChIKey of 3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide?
The InChIKey is VEQIWQAAAMZPRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O3.C19H18N4O3.C18H18N6O2.2C18H16N6O2.C18H16N4O3.C17H14F2N4O4.C16H15ClN4O2/c1-4-18-22-16-7-13(5-6-17(16)26-18)19(25)21-14-8-20-24(9-14)10-15-11(2)23-27-12(15)3;1-11-6-15-7-14(4-5-18(15)25-11)19(24)21-16-8-20-23(9-16)10-17-12(2)22-26-13(17)3;1-10-15(11(2)26-23-10)9-24-8-14(7-19-24)22-18(25)13-4-5-16-17(6-13)21-12(3)20-16;1-11-15(12(2)26-23-11)10-24-9-14(8-21-24)22-18(25)13-3-4-16-17(7-13)20-6-5-19-16;1-11-15(12(2)26-23-11)10-24-9-13(8-21-24)22-18(25)14-4-3-5-16-17(14)20-7-6-19-16;1-11-16(12(2)25-21-11)10-22-9-15(8-19-22)20-18(23)14-3-4-17-13(7-14)5-6-24-17;1-9-13(10(2)27-22-9)8-23-7-12(6-20-23)21-16(24)11-3-4-14-15(5-11)26-17(18,19)25-14;1-10-15(11(2)23-20-10)9-21-8-14(7-18-21)19-16(22)12-4-3-5-13(17)6-12/h5-9H,4,10H2,1-3H3,(H,21,25);4-9H,10H2,1-3H3,(H,21,24);4-8H,9H2,1-3H3,(H,20,21)(H,22,25);2*3-9H,10H2,1-2H3,(H,22,25);3-9H,10H2,1-2H3,(H,20,23);3-7H,8H2,1-2H3,(H,21,24);3-8H,9H2,1-2H3,(H,19,22).
What are the key properties of 3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide?
3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide has a molecular weight of 2806.33 g/mol, XLogP of 25.86, 33 rotatable bonds, 9 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]benzamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,3-benzoxazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-3H-benzimidazole-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1-benzofuran-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-5-carboxamide;N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]quinoxaline-6-carboxamide is sourced from PubChem (CID 161277573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).