dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride

C102H142Cl6F4K2N16O18Si3 — CID 162191156

IUPACdipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride
SMILESCC[C@@H](N)CO[Si](C)(C)C(C)(C)C.CC[C@H](CO)N(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC[C@H](CO[Si](C)(C)C(C)(C)C)N(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC[C@H](CO[Si](C)(C)C(C)(C)C)NCC(=O)NCc1cccc(Cl)c1F.Cl.NC(=O)c1nn(CC(=O)O)c2ccccc12.O=C(CCl)CCc1cccc(Cl)c1F.O=CO[O-].[H-].[K+].[K+]
InChIInChI=1S/C29H39ClFN5O4Si.C23H25ClFN5O4.C19H32ClFN2O2Si.C10H9Cl2FO.C10H9N3O3.C10H25NOSi.CH2O3.ClH.2K.H/c1-7-20(18-40-41(5,6)29(2,3)4)35(16-24(37)33-15-19-11-10-13-22(30)26(19)31)25(38)17-36-23-14-9-8-12-21(23)27(34-36)28(32)39;1-2-15(13-31)29(11-19(32)27-10-14-6-5-8-17(24)21(14)25)20(33)12-30-18-9-4-3-7-16(18)22(28-30)23(26)34;1-7-15(13-25-26(5,6)19(2,3)4)22-12-17(24)23-11-14-9-8-10-16(20)18(14)21;11-6-8(14)5-4-7-2-1-3-9(12)10(7)13;11-10(16)9-6-3-1-2-4-7(6)13(12-9)5-8(14)15;1-7-9(11)8-12-13(5,6)10(2,3)4;2-1-4-3;;;;/h8-14,20H,7,15-18H2,1-6H3,(H2,32,39)(H,33,37);3-9,15,31H,2,10-13H2,1H3,(H2,26,34)(H,27,32);8-10,15,22H,7,11-13H2,1-6H3,(H,23,24);1-3H,4-6H2;1-4H,5H2,(H2,11,16)(H,14,15);9H,7-8,11H2,1-6H3;1,3H;1H;;;/q;;;;;;;;2*+1;-1/p-1/t20-;2*15-;;;9-;;;;;/m111..1...../s1
InChIKeyALMHEFWEMLVYBK-OYXZJNPYSA-M
MW2331.52 g/mol
LogP10.36
Rot. Bonds43

About dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride

dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride (PubChem CID 162191156) has the molecular formula C102H142Cl6F4K2N16O18Si3 and a molecular weight of 2331.52 g/mol. Its IUPAC name is dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride.

Molecular Properties

Compound Namedipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride
PubChem CID162191156
Molecular FormulaC102H142Cl6F4K2N16O18Si3
Molecular Weight2331.52 g/mol
Exact Mass2326.73
IUPAC Namedipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride
SMILESCC[C@@H](N)CO[Si](C)(C)C(C)(C)C.CC[C@H](CO)N(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC[C@H](CO[Si](C)(C)C(C)(C)C)N(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC[C@H](CO[Si](C)(C)C(C)(C)C)NCC(=O)NCc1cccc(Cl)c1F.Cl.NC(=O)c1nn(CC(=O)O)c2ccccc12.O=C(CCl)CCc1cccc(Cl)c1F.O=CO[O-].[H-].[K+].[K+]
InChIInChI=1S/C29H39ClFN5O4Si.C23H25ClFN5O4.C19H32ClFN2O2Si.C10H9Cl2FO.C10H9N3O3.C10H25NOSi.CH2O3.ClH.2K.H/c1-7-20(18-40-41(5,6)29(2,3)4)35(16-24(37)33-15-19-11-10-13-22(30)26(19)31)25(38)17-36-23-14-9-8-12-21(23)27(34-36)28(32)39;1-2-15(13-31)29(11-19(32)27-10-14-6-5-8-17(24)21(14)25)20(33)12-30-18-9-4-3-7-16(18)22(28-30)23(26)34;1-7-15(13-25-26(5,6)19(2,3)4)22-12-17(24)23-11-14-9-8-10-16(20)18(14)21;11-6-8(14)5-4-7-2-1-3-9(12)10(7)13;11-10(16)9-6-3-1-2-4-7(6)13(12-9)5-8(14)15;1-7-9(11)8-12-13(5,6)10(2,3)4;2-1-4-3;;;;/h8-14,20H,7,15-18H2,1-6H3,(H2,32,39)(H,33,37);3-9,15,31H,2,10-13H2,1H3,(H2,26,34)(H,27,32);8-10,15,22H,7,11-13H2,1-6H3,(H,23,24);1-3H,4-6H2;1-4H,5H2,(H2,11,16)(H,14,15);9H,7-8,11H2,1-6H3;1,3H;1H;;;/q;;;;;;;;2*+1;-1/p-1/t20-;2*15-;;;9-;;;;;/m111..1...../s1
InChIKeyALMHEFWEMLVYBK-OYXZJNPYSA-M
XLogP10.36
TPSA500.35 Ų
H-Bond Donors10
H-Bond Acceptors25
Rotatable Bonds43
Heavy Atoms151
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002331.52
LogP ≤ 510.36
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Analyze dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride?
The IUPAC name of dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride (CID 162191156) is dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride.
What is the SMILES notation for dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride?
The canonical SMILES for dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride is CC[C@@H](N)CO[Si](C)(C)C(C)(C)C.CC[C@H](CO)N(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC[C@H](CO[Si](C)(C)C(C)(C)C)N(CC(=O)NCc1cccc(Cl)c1F)C(=O)Cn1nc(C(N)=O)c2ccccc21.CC[C@H](CO[Si](C)(C)C(C)(C)C)NCC(=O)NCc1cccc(Cl)c1F.Cl.NC(=O)c1nn(CC(=O)O)c2ccccc12.O=C(CCl)CCc1cccc(Cl)c1F.O=CO[O-].[H-].[K+].[K+].
What is the InChIKey of dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride?
The InChIKey is ALMHEFWEMLVYBK-OYXZJNPYSA-M. The full InChI is InChI=1S/C29H39ClFN5O4Si.C23H25ClFN5O4.C19H32ClFN2O2Si.C10H9Cl2FO.C10H9N3O3.C10H25NOSi.CH2O3.ClH.2K.H/c1-7-20(18-40-41(5,6)29(2,3)4)35(16-24(37)33-15-19-11-10-13-22(30)26(19)31)25(38)17-36-23-14-9-8-12-21(23)27(34-36)28(32)39;1-2-15(13-31)29(11-19(32)27-10-14-6-5-8-17(24)21(14)25)20(33)12-30-18-9-4-3-7-16(18)22(28-30)23(26)34;1-7-15(13-25-26(5,6)19(2,3)4)22-12-17(24)23-11-14-9-8-10-16(20)18(14)21;11-6-8(14)5-4-7-2-1-3-9(12)10(7)13;11-10(16)9-6-3-1-2-4-7(6)13(12-9)5-8(14)15;1-7-9(11)8-12-13(5,6)10(2,3)4;2-1-4-3;;;;/h8-14,20H,7,15-18H2,1-6H3,(H2,32,39)(H,33,37);3-9,15,31H,2,10-13H2,1H3,(H2,26,34)(H,27,32);8-10,15,22H,7,11-13H2,1-6H3,(H,23,24);1-3H,4-6H2;1-4H,5H2,(H2,11,16)(H,14,15);9H,7-8,11H2,1-6H3;1,3H;1H;;;/q;;;;;;;;2*+1;-1/p-1/t20-;2*15-;;;9-;;;;;/m111..1...../s1.
What are the key properties of dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride?
dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride has a molecular weight of 2331.52 g/mol, XLogP of 10.36, 43 rotatable bonds, 10 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for dipotassium;(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-amine;2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]amino]-N-[(3-chloro-2-fluorophenyl)methyl]acetamide;1-[2-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-oxoethyl]indazole-3-carboxamide;2-(3-carbamoylindazol-1-yl)acetic acid;1-chloro-4-(3-chloro-2-fluorophenyl)butan-2-one;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]indazole-3-carboxamide;hydride;oxido formate;hydrochloride is sourced from PubChem (CID 162191156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).