2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide

C166H178Cl7F3N44O22 — CID 159882410

IUPAC2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide
SMILESCC(C)NC(=O)CN1CCCc2cc(-c3nc(Cc4ccc5[nH]ncc5c4Cl)n(C)n3)ccc21.CC(C)NC(=O)CN1CCOc2cc(-c3nc(Cc4ccc5[nH]ncc5c4Cl)n(C)n3)ccc21.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NC(C)C(F)(F)F.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NC(C)CO.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NCC(C)(C)O.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NCC(C)O.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NCC1(O)CC1
InChIInChI=1S/C25H28ClN7O.C24H26ClN7O2.C24H25ClN6O4.C24H27ClN6O4.C23H22ClF3N6O3.2C23H25ClN6O4/c1-15(2)28-23(34)14-33-10-4-5-16-11-18(7-9-21(16)33)25-29-22(32(3)31-25)12-17-6-8-20-19(24(17)26)13-27-30-20;1-14(2)27-22(33)13-32-8-9-34-20-10-16(5-7-19(20)32)24-28-21(31(3)30-24)11-15-4-6-18-17(23(15)25)12-26-29-18;1-31-20(10-14-3-5-17-16(22(14)25)11-27-29-17)28-23(30-31)15-4-6-18(19(9-15)34-2)35-12-21(32)26-13-24(33)7-8-24;1-24(2,33)13-26-21(32)12-35-18-8-6-15(9-19(18)34-4)23-28-20(31(3)30-23)10-14-5-7-17-16(22(14)25)11-27-29-17;1-12(23(25,26)27)29-20(34)11-36-17-7-5-14(8-18(17)35-3)22-30-19(33(2)32-22)9-13-4-6-16-15(21(13)24)10-28-31-16;1-13(11-31)26-21(32)12-34-18-7-5-15(8-19(18)33-3)23-27-20(30(2)29-23)9-14-4-6-17-16(22(14)24)10-25-28-17;1-13(31)10-25-21(32)12-34-18-7-5-15(8-19(18)33-3)23-27-20(30(2)29-23)9-14-4-6-17-16(22(14)24)11-26-28-17/h6-9,11,13,15H,4-5,10,12,14H2,1-3H3,(H,27,30)(H,28,34);4-7,10,12,14H,8-9,11,13H2,1-3H3,(H,26,29)(H,27,33);3-6,9,11,33H,7-8,10,12-13H2,1-2H3,(H,26,32)(H,27,29);5-9,11,33H,10,12-13H2,1-4H3,(H,26,32)(H,27,29);4-8,10,12H,9,11H2,1-3H3,(H,28,31)(H,29,34);4-8,10,13,31H,9,11-12H2,1-3H3,(H,25,28)(H,26,32);4-8,11,13,31H,9-10,12H2,1-3H3,(H,25,32)(H,26,28)
InChIKeyNTRNMYCFYZBXSA-UHFFFAOYSA-N
MW3446.70 g/mol
LogP21.75
Rot. Bonds56

About 2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide

2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide (PubChem CID 159882410) has the molecular formula C166H178Cl7F3N44O22 and a molecular weight of 3446.70 g/mol. Its IUPAC name is 2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide.

Molecular Properties

Compound Name2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide
PubChem CID159882410
Molecular FormulaC166H178Cl7F3N44O22
Molecular Weight3446.70 g/mol
Exact Mass3441.19
IUPAC Name2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide
SMILESCC(C)NC(=O)CN1CCCc2cc(-c3nc(Cc4ccc5[nH]ncc5c4Cl)n(C)n3)ccc21.CC(C)NC(=O)CN1CCOc2cc(-c3nc(Cc4ccc5[nH]ncc5c4Cl)n(C)n3)ccc21.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NC(C)C(F)(F)F.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NC(C)CO.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NCC(C)(C)O.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NCC(C)O.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NCC1(O)CC1
InChIInChI=1S/C25H28ClN7O.C24H26ClN7O2.C24H25ClN6O4.C24H27ClN6O4.C23H22ClF3N6O3.2C23H25ClN6O4/c1-15(2)28-23(34)14-33-10-4-5-16-11-18(7-9-21(16)33)25-29-22(32(3)31-25)12-17-6-8-20-19(24(17)26)13-27-30-20;1-14(2)27-22(33)13-32-8-9-34-20-10-16(5-7-19(20)32)24-28-21(31(3)30-24)11-15-4-6-18-17(23(15)25)12-26-29-18;1-31-20(10-14-3-5-17-16(22(14)25)11-27-29-17)28-23(30-31)15-4-6-18(19(9-15)34-2)35-12-21(32)26-13-24(33)7-8-24;1-24(2,33)13-26-21(32)12-35-18-8-6-15(9-19(18)34-4)23-28-20(31(3)30-23)10-14-5-7-17-16(22(14)25)11-27-29-17;1-12(23(25,26)27)29-20(34)11-36-17-7-5-14(8-18(17)35-3)22-30-19(33(2)32-22)9-13-4-6-16-15(21(13)24)10-28-31-16;1-13(11-31)26-21(32)12-34-18-7-5-15(8-19(18)33-3)23-27-20(30(2)29-23)9-14-4-6-17-16(22(14)24)10-25-28-17;1-13(31)10-25-21(32)12-34-18-7-5-15(8-19(18)33-3)23-27-20(30(2)29-23)9-14-4-6-17-16(22(14)24)11-26-28-17/h6-9,11,13,15H,4-5,10,12,14H2,1-3H3,(H,27,30)(H,28,34);4-7,10,12,14H,8-9,11,13H2,1-3H3,(H,26,29)(H,27,33);3-6,9,11,33H,7-8,10,12-13H2,1-2H3,(H,26,32)(H,27,29);5-9,11,33H,10,12-13H2,1-4H3,(H,26,32)(H,27,29);4-8,10,12H,9,11H2,1-3H3,(H,28,31)(H,29,34);4-8,10,13,31H,9,11-12H2,1-3H3,(H,25,28)(H,26,32);4-8,11,13,31H,9-10,12H2,1-3H3,(H,25,32)(H,26,28)
InChIKeyNTRNMYCFYZBXSA-UHFFFAOYSA-N
XLogP21.75
TPSA808.36 Ų
H-Bond Donors18
H-Bond Acceptors52
Rotatable Bonds56
Heavy Atoms242
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003446.70
LogP ≤ 521.75
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1052

Analyze 2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide with MolForge

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Related Compounds

2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]acetamide
CID 157239358
N-[5-(2-amino-4-pyridinyl)-2-methyl-1,2,4-triazol-3-yl]-4-chloro-1H-indazol-5-amine;N-[5-(5-amino-3-pyridinyl)-2-methyl-1,2,4-triazol-3-yl]-4-chloro-1H-indazol-5-amine;4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]benzamide;[6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-1H-isoquinolin-2-yl]-cyclopropylmethanone;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-pyrrolidin-3-ylacetamide;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-methylbenzamide;4-chloro-N-[2-methyl-5-(2-methylpyrazol-3-yl)-1,2,4-triazol-3-yl]-1H-indazol-5-amine;2-[4-[5-(1H-indazol-5-ylamino)-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide
CID 159386303
4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenol;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine
CID 160167152
4-chloro-N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(3,4-dimethoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;N-[[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]acetamide;N-[[3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-propan-2-yl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-propan-2-ylacetamide;4-chloro-N-[2-methyl-5-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen
CID 161073399
2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide
CID 161256083
2-[6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide
CID 167669657
1-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-methylanilino]-3-(dimethylamino)propan-2-one;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(2R)-1,1,1-trifluoropropan-2-yl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(2S)-1,1,1-trifluoropropan-2-yl]acetamide;1-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenyl]-3-methylurea
CID 167669762
5-[[5-(1-benzylpyrazol-4-yl)-2-methyl-1,2,4-triazol-3-yl]methyl]-4-chloro-1H-indazole;N-tert-butyl-2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxycyclohexyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxycyclopropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-1-(4-hydroxypiperidin-1-yl)ethanone;4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-N-methylbenzamide;[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]phenyl]-morpholin-4-ylmethanone;4-chloro-5-[[5-[4-(methoxymethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]methyl]-1H-indazole
CID 157203542
CID 157798990
CID 157798990
2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-morpholin-4-ylphenoxy]-N-propan-2-ylacetamide;2-[4-[5-(1H-indazol-5-ylmethyl)-4-pyridin-2-yl-1,2,4-triazol-3-yl]phenoxy]-N-propan-2-ylacetamide
CID 158064902
N-(azetidin-3-yl)-2-[2-methoxy-4-[1-methyl-5-[(4-methyl-1H-indazol-5-yl)methyl]-1,2,4-triazol-3-yl]phenoxy]acetamide;N-[[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenyl]methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-morpholin-4-ylphenoxy]-N-propan-2-ylacetamide;6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-N-propan-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;2-[4-[5-(1H-indazol-5-ylmethyl)-4-pyridin-2-yl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-propan-2-ylacetamide;2-[4-[5-(1H-indazol-5-ylmethyl)-4-pyridin-2-yl-1,2,4-triazol-3-yl]phenoxy]-N-propan-2-ylacetamide;2-[2-methoxy-4-[1-methyl-5-[(4-methyl-1H-indazol-5-yl)methyl]-1,2,4-triazol-3-yl]phenoxy]-N-propan-2-ylacetamide
CID 158262599
7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-chromen-4-ol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-cyclopentylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[2-(dimethylamino)ethyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-pyridin-2-ylethyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-pyridin-3-ylethyl)acetamide;5-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]pyridin-2-amine;2-[2-methoxy-4-[1-methyl-5-[(3-methyl-2H-indazol-5-yl)methyl]-1,2,4-triazol-3-yl]phenoxy]-N-propan-2-ylacetamide
CID 159176913

Frequently Asked Questions

What is the IUPAC name of 2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide?
The IUPAC name of 2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide (CID 159882410) is 2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide.
What is the SMILES notation for 2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide?
The canonical SMILES for 2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide is CC(C)NC(=O)CN1CCCc2cc(-c3nc(Cc4ccc5[nH]ncc5c4Cl)n(C)n3)ccc21.CC(C)NC(=O)CN1CCOc2cc(-c3nc(Cc4ccc5[nH]ncc5c4Cl)n(C)n3)ccc21.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NC(C)C(F)(F)F.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NC(C)CO.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NCC(C)(C)O.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NCC(C)O.COc1cc(-c2nc(Cc3ccc4[nH]ncc4c3Cl)n(C)n2)ccc1OCC(=O)NCC1(O)CC1.
What is the InChIKey of 2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide?
The InChIKey is NTRNMYCFYZBXSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28ClN7O.C24H26ClN7O2.C24H25ClN6O4.C24H27ClN6O4.C23H22ClF3N6O3.2C23H25ClN6O4/c1-15(2)28-23(34)14-33-10-4-5-16-11-18(7-9-21(16)33)25-29-22(32(3)31-25)12-17-6-8-20-19(24(17)26)13-27-30-20;1-14(2)27-22(33)13-32-8-9-34-20-10-16(5-7-19(20)32)24-28-21(31(3)30-24)11-15-4-6-18-17(23(15)25)12-26-29-18;1-31-20(10-14-3-5-17-16(22(14)25)11-27-29-17)28-23(30-31)15-4-6-18(19(9-15)34-2)35-12-21(32)26-13-24(33)7-8-24;1-24(2,33)13-26-21(32)12-35-18-8-6-15(9-19(18)34-4)23-28-20(31(3)30-23)10-14-5-7-17-16(22(14)25)11-27-29-17;1-12(23(25,26)27)29-20(34)11-36-17-7-5-14(8-18(17)35-3)22-30-19(33(2)32-22)9-13-4-6-16-15(21(13)24)10-28-31-16;1-13(11-31)26-21(32)12-34-18-7-5-15(8-19(18)33-3)23-27-20(30(2)29-23)9-14-4-6-17-16(22(14)24)10-25-28-17;1-13(31)10-25-21(32)12-34-18-7-5-15(8-19(18)33-3)23-27-20(30(2)29-23)9-14-4-6-17-16(22(14)24)11-26-28-17/h6-9,11,13,15H,4-5,10,12,14H2,1-3H3,(H,27,30)(H,28,34);4-7,10,12,14H,8-9,11,13H2,1-3H3,(H,26,29)(H,27,33);3-6,9,11,33H,7-8,10,12-13H2,1-2H3,(H,26,32)(H,27,29);5-9,11,33H,10,12-13H2,1-4H3,(H,26,32)(H,27,29);4-8,10,12H,9,11H2,1-3H3,(H,28,31)(H,29,34);4-8,10,13,31H,9,11-12H2,1-3H3,(H,25,28)(H,26,32);4-8,11,13,31H,9-10,12H2,1-3H3,(H,25,32)(H,26,28).
What are the key properties of 2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide?
2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide has a molecular weight of 3446.70 g/mol, XLogP of 21.75, 56 rotatable bonds, 18 hydrogen bond donors, and 52 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2,3-dihydro-1,4-benzoxazin-4-yl]-N-propan-2-ylacetamide;2-[6-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-propan-2-ylacetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-[(1-hydroxycyclopropyl)methyl]acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxy-2-methylpropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1-hydroxypropan-2-yl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(2-hydroxypropyl)acetamide;2-[4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-2-methoxyphenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide is sourced from PubChem (CID 159882410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).