1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide

C219H223Br2Cl8F9N48O32 — CID 157495833

IUPAC1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide
SMILESCC(C)CN(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC(C)N(CC(=O)NCc1cccc(Br)n1)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC(C)N(CC(=O)NCc1cccc(Cl)c1F)C(=O)CN1C(=O)c2ccccc2C1=O.CC(C)N(CC(=O)Nc1cccc(Br)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC(C)N(CC(=O)Nc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC(O)[C@H](NC(=O)Cn1nc(C(N)=O)c2ccccc21)C(=O)CCc1cccc(Cl)c1F.CCCN(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CCN(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.NC(=O)c1nn(CC(=O)N(CC(=O)NCc2cccc(Cl)c2F)C2CCC2)c2ccccc12.NC(=O)c1nn(CC(=O)N(CC(=O)NCc2cccc(Cl)c2F)CC2CC2)c2ccccc12
InChIInChI=1S/2C23H23ClFN5O3.C23H25ClFN5O3.C22H23ClFN5O3.C22H22ClFN4O4.C22H21ClFN3O4.C21H21BrFN5O3.C21H23BrN6O3.2C21H21ClFN5O3/c24-17-9-3-5-14(21(17)25)11-27-19(31)12-29(15-6-4-7-15)20(32)13-30-18-10-2-1-8-16(18)22(28-30)23(26)33;24-17-6-3-4-15(21(17)25)10-27-19(31)12-29(11-14-8-9-14)20(32)13-30-18-7-2-1-5-16(18)22(28-30)23(26)33;1-14(2)11-29(12-19(31)27-10-15-6-5-8-17(24)21(15)25)20(32)13-30-18-9-4-3-7-16(18)22(28-30)23(26)33;1-2-10-28(12-18(30)26-11-14-6-5-8-16(23)20(14)24)19(31)13-29-17-9-4-3-7-15(17)21(27-29)22(25)32;1-12(29)20(17(30)10-9-13-5-4-7-15(23)19(13)24)26-18(31)11-28-16-8-3-2-6-14(16)21(27-28)22(25)32;1-13(2)26(11-18(28)25-10-14-6-5-9-17(23)20(14)24)19(29)12-27-21(30)15-7-3-4-8-16(15)22(27)31;1-12(2)27(10-17(29)25-15-8-5-7-14(22)19(15)23)18(30)11-28-16-9-4-3-6-13(16)20(26-28)21(24)31;1-13(2)27(11-18(29)24-10-14-6-5-9-17(22)25-14)19(30)12-28-16-8-4-3-7-15(16)20(26-28)21(23)31;1-12(2)27(10-17(29)25-15-8-5-7-14(22)19(15)23)18(30)11-28-16-9-4-3-6-13(16)20(26-28)21(24)31;1-2-27(11-17(29)25-10-13-6-5-8-15(22)19(13)23)18(30)12-28-16-9-4-3-7-14(16)20(26-28)21(24)31/h1-3,5,8-10,15H,4,6-7,11-13H2,(H2,26,33)(H,27,31);1-7,14H,8-13H2,(H2,26,33)(H,27,31);3-9,14H,10-13H2,1-2H3,(H2,26,33)(H,27,31);3-9H,2,10-13H2,1H3,(H2,25,32)(H,26,30);2-8,12,20,29H,9-11H2,1H3,(H2,25,32)(H,26,31);3-9,13H,10-12H2,1-2H3,(H,25,28);3-9,12H,10-11H2,1-2H3,(H2,24,31)(H,25,29);3-9,13H,10-12H2,1-2H3,(H2,23,31)(H,24,29);3-9,12H,10-11H2,1-2H3,(H2,24,31)(H,25,29);3-9H,2,10-12H2,1H3,(H2,24,31)(H,25,29)/t;;;;12?,20-;;;;;/m....0...../s1
InChIKeyBXVDEHZIZXQIPY-ZORRGGKRSA-N
MW4653.91 g/mol
LogP24.60
Rot. Bonds81

About 1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide

1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide (PubChem CID 157495833) has the molecular formula C219H223Br2Cl8F9N48O32 and a molecular weight of 4653.91 g/mol. Its IUPAC name is 1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide.

Molecular Properties

Compound Name1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide
PubChem CID157495833
Molecular FormulaC219H223Br2Cl8F9N48O32
Molecular Weight4653.91 g/mol
Exact Mass4645.30
IUPAC Name1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide
SMILESCC(C)CN(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC(C)N(CC(=O)NCc1cccc(Br)n1)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC(C)N(CC(=O)NCc1cccc(Cl)c1F)C(=O)CN1C(=O)c2ccccc2C1=O.CC(C)N(CC(=O)Nc1cccc(Br)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC(C)N(CC(=O)Nc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC(O)[C@H](NC(=O)Cn1nc(C(N)=O)c2ccccc21)C(=O)CCc1cccc(Cl)c1F.CCCN(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CCN(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.NC(=O)c1nn(CC(=O)N(CC(=O)NCc2cccc(Cl)c2F)C2CCC2)c2ccccc12.NC(=O)c1nn(CC(=O)N(CC(=O)NCc2cccc(Cl)c2F)CC2CC2)c2ccccc12
InChIInChI=1S/2C23H23ClFN5O3.C23H25ClFN5O3.C22H23ClFN5O3.C22H22ClFN4O4.C22H21ClFN3O4.C21H21BrFN5O3.C21H23BrN6O3.2C21H21ClFN5O3/c24-17-9-3-5-14(21(17)25)11-27-19(31)12-29(15-6-4-7-15)20(32)13-30-18-10-2-1-8-16(18)22(28-30)23(26)33;24-17-6-3-4-15(21(17)25)10-27-19(31)12-29(11-14-8-9-14)20(32)13-30-18-7-2-1-5-16(18)22(28-30)23(26)33;1-14(2)11-29(12-19(31)27-10-15-6-5-8-17(24)21(15)25)20(32)13-30-18-9-4-3-7-16(18)22(28-30)23(26)33;1-2-10-28(12-18(30)26-11-14-6-5-8-16(23)20(14)24)19(31)13-29-17-9-4-3-7-15(17)21(27-29)22(25)32;1-12(29)20(17(30)10-9-13-5-4-7-15(23)19(13)24)26-18(31)11-28-16-8-3-2-6-14(16)21(27-28)22(25)32;1-13(2)26(11-18(28)25-10-14-6-5-9-17(23)20(14)24)19(29)12-27-21(30)15-7-3-4-8-16(15)22(27)31;1-12(2)27(10-17(29)25-15-8-5-7-14(22)19(15)23)18(30)11-28-16-9-4-3-6-13(16)20(26-28)21(24)31;1-13(2)27(11-18(29)24-10-14-6-5-9-17(22)25-14)19(30)12-28-16-8-4-3-7-15(16)20(26-28)21(23)31;1-12(2)27(10-17(29)25-15-8-5-7-14(22)19(15)23)18(30)11-28-16-9-4-3-6-13(16)20(26-28)21(24)31;1-2-27(11-17(29)25-10-13-6-5-8-15(22)19(13)23)18(30)12-28-16-9-4-3-7-14(16)20(26-28)21(24)31/h1-3,5,8-10,15H,4,6-7,11-13H2,(H2,26,33)(H,27,31);1-7,14H,8-13H2,(H2,26,33)(H,27,31);3-9,14H,10-13H2,1-2H3,(H2,26,33)(H,27,31);3-9H,2,10-13H2,1H3,(H2,25,32)(H,26,30);2-8,12,20,29H,9-11H2,1H3,(H2,25,32)(H,26,31);3-9,13H,10-12H2,1-2H3,(H,25,28);3-9,12H,10-11H2,1-2H3,(H2,24,31)(H,25,29);3-9,13H,10-12H2,1-2H3,(H2,23,31)(H,24,29);3-9,12H,10-11H2,1-2H3,(H2,24,31)(H,25,29);3-9H,2,10-12H2,1H3,(H2,24,31)(H,25,29)/t;;;;12?,20-;;;;;/m....0...../s1
InChIKeyBXVDEHZIZXQIPY-ZORRGGKRSA-N
XLogP24.60
TPSA1109.55 Ų
H-Bond Donors20
H-Bond Acceptors51
Rotatable Bonds81
Heavy Atoms318
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004653.91
LogP ≤ 524.60
H-Bond Donors ≤ 520
H-Bond Acceptors ≤ 1051

Analyze 1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide?
The IUPAC name of 1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide (CID 157495833) is 1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide.
What is the SMILES notation for 1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide?
The canonical SMILES for 1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide is CC(C)CN(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC(C)N(CC(=O)NCc1cccc(Br)n1)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC(C)N(CC(=O)NCc1cccc(Cl)c1F)C(=O)CN1C(=O)c2ccccc2C1=O.CC(C)N(CC(=O)Nc1cccc(Br)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC(C)N(CC(=O)Nc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC(O)[C@H](NC(=O)Cn1nc(C(N)=O)c2ccccc21)C(=O)CCc1cccc(Cl)c1F.CCCN(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CCN(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.NC(=O)c1nn(CC(=O)N(CC(=O)NCc2cccc(Cl)c2F)C2CCC2)c2ccccc12.NC(=O)c1nn(CC(=O)N(CC(=O)NCc2cccc(Cl)c2F)CC2CC2)c2ccccc12.
What is the InChIKey of 1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide?
The InChIKey is BXVDEHZIZXQIPY-ZORRGGKRSA-N. The full InChI is InChI=1S/2C23H23ClFN5O3.C23H25ClFN5O3.C22H23ClFN5O3.C22H22ClFN4O4.C22H21ClFN3O4.C21H21BrFN5O3.C21H23BrN6O3.2C21H21ClFN5O3/c24-17-9-3-5-14(21(17)25)11-27-19(31)12-29(15-6-4-7-15)20(32)13-30-18-10-2-1-8-16(18)22(28-30)23(26)33;24-17-6-3-4-15(21(17)25)10-27-19(31)12-29(11-14-8-9-14)20(32)13-30-18-7-2-1-5-16(18)22(28-30)23(26)33;1-14(2)11-29(12-19(31)27-10-15-6-5-8-17(24)21(15)25)20(32)13-30-18-9-4-3-7-16(18)22(28-30)23(26)33;1-2-10-28(12-18(30)26-11-14-6-5-8-16(23)20(14)24)19(31)13-29-17-9-4-3-7-15(17)21(27-29)22(25)32;1-12(29)20(17(30)10-9-13-5-4-7-15(23)19(13)24)26-18(31)11-28-16-8-3-2-6-14(16)21(27-28)22(25)32;1-13(2)26(11-18(28)25-10-14-6-5-9-17(23)20(14)24)19(29)12-27-21(30)15-7-3-4-8-16(15)22(27)31;1-12(2)27(10-17(29)25-15-8-5-7-14(22)19(15)23)18(30)11-28-16-9-4-3-6-13(16)20(26-28)21(24)31;1-13(2)27(11-18(29)24-10-14-6-5-9-17(22)25-14)19(30)12-28-16-8-4-3-7-15(16)20(26-28)21(23)31;1-12(2)27(10-17(29)25-15-8-5-7-14(22)19(15)23)18(30)11-28-16-9-4-3-6-13(16)20(26-28)21(24)31;1-2-27(11-17(29)25-10-13-6-5-8-15(22)19(13)23)18(30)12-28-16-9-4-3-7-14(16)20(26-28)21(24)31/h1-3,5,8-10,15H,4,6-7,11-13H2,(H2,26,33)(H,27,31);1-7,14H,8-13H2,(H2,26,33)(H,27,31);3-9,14H,10-13H2,1-2H3,(H2,26,33)(H,27,31);3-9H,2,10-13H2,1H3,(H2,25,32)(H,26,30);2-8,12,20,29H,9-11H2,1H3,(H2,25,32)(H,26,31);3-9,13H,10-12H2,1-2H3,(H,25,28);3-9,12H,10-11H2,1-2H3,(H2,24,31)(H,25,29);3-9,13H,10-12H2,1-2H3,(H2,23,31)(H,24,29);3-9,12H,10-11H2,1-2H3,(H2,24,31)(H,25,29);3-9H,2,10-12H2,1H3,(H2,24,31)(H,25,29)/t;;;;12?,20-;;;;;/m....0...../s1.
What are the key properties of 1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide?
1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide has a molecular weight of 4653.91 g/mol, XLogP of 24.60, 81 rotatable bonds, 20 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[[2-(3-bromo-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(6-bromo-2-pyridinyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-(3-chloro-2-fluoroanilino)-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[(3S)-6-(3-chloro-2-fluorophenyl)-2-hydroxy-4-oxohexan-3-yl]amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclobutylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(cyclopropylmethyl)amino]-2-oxoethyl]indazole-3-carboxamide;N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-(2-methylpropyl)amino]-2-oxoethyl]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propylamino]-2-oxoethyl]indazole-3-carboxamide is sourced from PubChem (CID 157495833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).