4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide

C126H85BrF16N30O15 — CID 159218553

IUPAC4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide
SMILESCOc1ccc(C(=O)Nc2n[nH]c(-c3ccc(Oc4cccnc4)cc3)n2)cc1C(F)(F)F.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1ccc(Br)cc1.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1ccc(F)c(C(F)(F)F)c1.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1ccc(OC(F)(F)F)cc1.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1cccc(C(F)(F)F)c1.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1cccc(OC(F)(F)F)c1
InChIInChI=1S/C22H16F3N5O3.C21H13F4N5O2.2C21H14F3N5O3.C21H14F3N5O2.C20H14BrN5O2/c1-32-18-9-6-14(11-17(18)22(23,24)25)20(31)28-21-27-19(29-30-21)13-4-7-15(8-5-13)33-16-3-2-10-26-12-16;22-17-8-5-13(10-16(17)21(23,24)25)19(31)28-20-27-18(29-30-20)12-3-6-14(7-4-12)32-15-2-1-9-26-11-15;22-21(23,24)32-16-4-1-3-14(11-16)19(30)27-20-26-18(28-29-20)13-6-8-15(9-7-13)31-17-5-2-10-25-12-17;22-21(23,24)32-16-9-5-14(6-10-16)19(30)27-20-26-18(28-29-20)13-3-7-15(8-4-13)31-17-2-1-11-25-12-17;22-21(23,24)15-4-1-3-14(11-15)19(30)27-20-26-18(28-29-20)13-6-8-16(9-7-13)31-17-5-2-10-25-12-17;21-15-7-3-14(4-8-15)19(27)24-20-23-18(25-26-20)13-5-9-16(10-6-13)28-17-2-1-11-22-12-17/h2-12H,1H3,(H2,27,28,29,30,31);1-11H,(H2,27,28,29,30,31);2*1-12H,(H2,26,27,28,29,30);1-12H,(H2,26,27,28,29,30);1-12H,(H2,23,24,25,26,27)
InChIKeyKRJUJRWAKHQCND-UHFFFAOYSA-N
MW2643.13 g/mol
LogP29.23
Rot. Bonds33

About 4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide

4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide (PubChem CID 159218553) has the molecular formula C126H85BrF16N30O15 and a molecular weight of 2643.13 g/mol. Its IUPAC name is 4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide
PubChem CID159218553
Molecular FormulaC126H85BrF16N30O15
Molecular Weight2643.13 g/mol
Exact Mass2640.57
IUPAC Name4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide
SMILESCOc1ccc(C(=O)Nc2n[nH]c(-c3ccc(Oc4cccnc4)cc3)n2)cc1C(F)(F)F.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1ccc(Br)cc1.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1ccc(F)c(C(F)(F)F)c1.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1ccc(OC(F)(F)F)cc1.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1cccc(C(F)(F)F)c1.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1cccc(OC(F)(F)F)c1
InChIInChI=1S/C22H16F3N5O3.C21H13F4N5O2.2C21H14F3N5O3.C21H14F3N5O2.C20H14BrN5O2/c1-32-18-9-6-14(11-17(18)22(23,24)25)20(31)28-21-27-19(29-30-21)13-4-7-15(8-5-13)33-16-3-2-10-26-12-16;22-17-8-5-13(10-16(17)21(23,24)25)19(31)28-20-27-18(29-30-20)12-3-6-14(7-4-12)32-15-2-1-9-26-11-15;22-21(23,24)32-16-4-1-3-14(11-16)19(30)27-20-26-18(28-29-20)13-6-8-15(9-7-13)31-17-5-2-10-25-12-17;22-21(23,24)32-16-9-5-14(6-10-16)19(30)27-20-26-18(28-29-20)13-3-7-15(8-4-13)31-17-2-1-11-25-12-17;22-21(23,24)15-4-1-3-14(11-15)19(30)27-20-26-18(28-29-20)13-6-8-16(9-7-13)31-17-5-2-10-25-12-17;21-15-7-3-14(4-8-15)19(27)24-20-23-18(25-26-20)13-5-9-16(10-6-13)28-17-2-1-11-22-12-17/h2-12H,1H3,(H2,27,28,29,30,31);1-11H,(H2,27,28,29,30,31);2*1-12H,(H2,26,27,28,29,30);1-12H,(H2,26,27,28,29,30);1-12H,(H2,23,24,25,26,27)
InChIKeyKRJUJRWAKHQCND-UHFFFAOYSA-N
XLogP29.23
TPSA584.43 Ų
H-Bond Donors12
H-Bond Acceptors33
Rotatable Bonds33
Heavy Atoms188
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002643.13
LogP ≤ 529.23
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1033

Analyze 4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide with MolForge

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Related Compounds

4-methoxy-6-[4-[3-[3-(trifluoromethyl)anilino]-1H-1,2,4-triazol-5-yl]phenoxy]pyrimidin-2-amine;2-methylsulfanyl-6-[4-[3-[3-(trifluoromethyl)anilino]-1H-1,2,4-triazol-5-yl]phenoxy]pyrimidin-4-amine;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;5-(4-pyridin-3-yloxyphenyl)-N-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine;5-(4-pyrimidin-5-yloxyphenyl)-N-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine;6-[4-[3-[3-(trifluoromethyl)anilino]-1H-1,2,4-triazol-5-yl]phenoxy]pyrimidin-4-amine;6-[4-[3-[3-(trifluoromethyl)anilino]-1H-1,2,4-triazol-5-yl]phenoxy]pyrimidine-2,4-diamine
CID 157405934
4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;2-methylsulfanyl-6-[4-[3-[3-(trifluoromethyl)anilino]-1H-1,2,4-triazol-5-yl]phenoxy]pyrimidin-4-amine;4-methyl-6-[4-[3-[3-(trifluoromethyl)anilino]-1H-1,2,4-triazol-5-yl]phenoxy]pyrimidin-2-amine;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethyl)benzamide;5-(4-pyridin-3-yloxyphenyl)-N-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine;6-[4-[3-[3-(trifluoromethyl)anilino]-1H-1,2,4-triazol-5-yl]phenoxy]pyrimidin-4-amine
CID 158025295
4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;5-(4-pyridin-3-yloxyphenyl)-N-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine
CID 160893480
4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;3-chloro-2-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-5-(trifluoromethyl)benzamide;2,2-difluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-1,3-benzodioxole-5-carboxamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide
CID 161291807
3-chloro-2-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-5-(trifluoromethyl)benzamide;2,2-difluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-1,3-benzodioxole-5-carboxamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide
CID 161399818
4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;3-chloro-2-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-5-(trifluoromethyl)benzamide;2,2-difluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-1,3-benzodioxole-5-carboxamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide
CID 161518544

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide?
The IUPAC name of 4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide (CID 159218553) is 4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide.
What is the SMILES notation for 4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide?
The canonical SMILES for 4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide is COc1ccc(C(=O)Nc2n[nH]c(-c3ccc(Oc4cccnc4)cc3)n2)cc1C(F)(F)F.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1ccc(Br)cc1.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1ccc(F)c(C(F)(F)F)c1.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1ccc(OC(F)(F)F)cc1.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1cccc(C(F)(F)F)c1.O=C(Nc1n[nH]c(-c2ccc(Oc3cccnc3)cc2)n1)c1cccc(OC(F)(F)F)c1.
What is the InChIKey of 4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide?
The InChIKey is KRJUJRWAKHQCND-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16F3N5O3.C21H13F4N5O2.2C21H14F3N5O3.C21H14F3N5O2.C20H14BrN5O2/c1-32-18-9-6-14(11-17(18)22(23,24)25)20(31)28-21-27-19(29-30-21)13-4-7-15(8-5-13)33-16-3-2-10-26-12-16;22-17-8-5-13(10-16(17)21(23,24)25)19(31)28-20-27-18(29-30-20)12-3-6-14(7-4-12)32-15-2-1-9-26-11-15;22-21(23,24)32-16-4-1-3-14(11-16)19(30)27-20-26-18(28-29-20)13-6-8-15(9-7-13)31-17-5-2-10-25-12-17;22-21(23,24)32-16-9-5-14(6-10-16)19(30)27-20-26-18(28-29-20)13-3-7-15(8-4-13)31-17-2-1-11-25-12-17;22-21(23,24)15-4-1-3-14(11-15)19(30)27-20-26-18(28-29-20)13-6-8-16(9-7-13)31-17-5-2-10-25-12-17;21-15-7-3-14(4-8-15)19(27)24-20-23-18(25-26-20)13-5-9-16(10-6-13)28-17-2-1-11-22-12-17/h2-12H,1H3,(H2,27,28,29,30,31);1-11H,(H2,27,28,29,30,31);2*1-12H,(H2,26,27,28,29,30);1-12H,(H2,26,27,28,29,30);1-12H,(H2,23,24,25,26,27).
What are the key properties of 4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide?
4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide has a molecular weight of 2643.13 g/mol, XLogP of 29.23, 33 rotatable bonds, 12 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide;4-fluoro-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;4-methoxy-N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(trifluoromethoxy)benzamide;N-[5-(4-pyridin-3-yloxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)benzamide is sourced from PubChem (CID 159218553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).