potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride

C120H130BBr5Cl9F7IKN26O20S — CID 162259606

About potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride

potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride (PubChem CID 162259606) has the molecular formula C120H130BBr5Cl9F7IKN26O20S and a molecular weight of 3316.99 g/mol. Its IUPAC name is potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride.

Molecular Properties

• Compound Name: potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride
• PubChem CID: 162259606
• Molecular Formula: C120H130BBr5Cl9F7IKN26O20S
• Molecular Weight: 3316.99 g/mol
• Exact Mass: 3306.15
• IUPAC Name: potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride
• SMILES: CC(C)(C)OC(=O)N1CCN(c2nc(Cl)nc3cc(Br)c(Cl)cc23)CC1.CC(C)(C)OC(=O)N1CCN(c2nc(F)nc3cc(Br)c(Cl)cc23)CC1.CC(C)(C)OC(=O)N1CCNCC1.COC(=O)C(F)(F)S(=O)(=O)F.Cc1ccc(I)c(-c2cc3nc(F)nc(N4CCN(C(=O)OC(C)(C)C)CC4)c3cc2Cl)n1.Cc1cccc(-c2cc3nc(F)nc(N4CCN(C(=O)OC(C)(C)C)CC4)c3cc2Cl)n1.Cc1cccc(B(O)O)n1.NC(=O)c1cc(Cl)c(Br)cc1N.Nc1cc(Br)c(Cl)cc1C(=O)O.O=c1[nH]c(Cl)nc2cc(Br)c(Cl)cc12.[F-].[K+]
• InChI: InChI=1S/C23H24ClFIN5O2.C23H25ClFN5O2.C17H19BrCl2N4O2.C17H19BrClFN4O2.C9H18N2O2.C8H3BrCl2N2O.C7H6BrClN2O.C7H5BrClNO2.C6H8BNO2.C3H3F3O4S.FH.K/c1-13-5-6-17(26)19(27-13)14-12-18-15(11-16(14)24)20(29-21(25)28-18)30-7-9-31(10-8-30)22(32)33-23(2,3)4;1-14-6-5-7-18(26-14)15-13-19-16(12-17(15)24)20(28-21(25)27-19)29-8-10-30(11-9-29)22(31)32-23(2,3)4;2*1-17(2,3)26-16(25)24-6-4-23(5-7-24)14-10-8-12(19)11(18)9-13(10)21-15(20)22-14;1-9(2,3)13-8(12)11-6-4-10-5-7-11;9-4-2-6-3(1-5(4)10)7(14)13-8(11)12-6;2*8-4-2-6(10)3(7(11)12)1-5(4)9;1-5-3-2-4-6(8-5)7(9)10;1-10-2(7)3(4,5)11(6,8)9;;/h5-6,11-12H,7-10H2,1-4H3;5-7,12-13H,8-11H2,1-4H3;2*8-9H,4-7H2,1-3H3;10H,4-7H2,1-3H3;1-2H,(H,12,13,14);1-2H,10H2,(H2,11,12);1-2H,10H2,(H,11,12);2-4,9-10H,1H3;1H3;1H;/q;;;;;;;;;;;+1/p-1
• InChIKey: ZZBCAKOTFIGKES-UHFFFAOYSA-M
• XLogP: 20.42
• TPSA: 593.56 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 38
• Rotatable Bonds: 11
• Heavy Atoms: 191
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3316.99
LogP ≤ 5	20.42
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride?

The IUPAC name of potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride (CID 162259606) is potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride.

What is the SMILES notation for potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride?

The canonical SMILES for potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride is CC(C)(C)OC(=O)N1CCN(c2nc(Cl)nc3cc(Br)c(Cl)cc23)CC1.CC(C)(C)OC(=O)N1CCN(c2nc(F)nc3cc(Br)c(Cl)cc23)CC1.CC(C)(C)OC(=O)N1CCNCC1.COC(=O)C(F)(F)S(=O)(=O)F.Cc1ccc(I)c(-c2cc3nc(F)nc(N4CCN(C(=O)OC(C)(C)C)CC4)c3cc2Cl)n1.Cc1cccc(-c2cc3nc(F)nc(N4CCN(C(=O)OC(C)(C)C)CC4)c3cc2Cl)n1.Cc1cccc(B(O)O)n1.NC(=O)c1cc(Cl)c(Br)cc1N.Nc1cc(Br)c(Cl)cc1C(=O)O.O=c1[nH]c(Cl)nc2cc(Br)c(Cl)cc12.[F-].[K+].

What is the InChIKey of potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride?

The InChIKey is ZZBCAKOTFIGKES-UHFFFAOYSA-M. The full InChI is InChI=1S/C23H24ClFIN5O2.C23H25ClFN5O2.C17H19BrCl2N4O2.C17H19BrClFN4O2.C9H18N2O2.C8H3BrCl2N2O.C7H6BrClN2O.C7H5BrClNO2.C6H8BNO2.C3H3F3O4S.FH.K/c1-13-5-6-17(26)19(27-13)14-12-18-15(11-16(14)24)20(29-21(25)28-18)30-7-9-31(10-8-30)22(32)33-23(2,3)4;1-14-6-5-7-18(26-14)15-13-19-16(12-17(15)24)20(28-21(25)27-19)29-8-10-30(11-9-29)22(31)32-23(2,3)4;2*1-17(2,3)26-16(25)24-6-4-23(5-7-24)14-10-8-12(19)11(18)9-13(10)21-15(20)22-14;1-9(2,3)13-8(12)11-6-4-10-5-7-11;9-4-2-6-3(1-5(4)10)7(14)13-8(11)12-6;2*8-4-2-6(10)3(7(11)12)1-5(4)9;1-5-3-2-4-6(8-5)7(9)10;1-10-2(7)3(4,5)11(6,8)9;;/h5-6,11-12H,7-10H2,1-4H3;5-7,12-13H,8-11H2,1-4H3;2*8-9H,4-7H2,1-3H3;10H,4-7H2,1-3H3;1-2H,(H,12,13,14);1-2H,10H2,(H2,11,12);1-2H,10H2,(H,11,12);2-4,9-10H,1H3;1H3;1H;/q;;;;;;;;;;;+1/p-1.

What are the key properties of potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride?

potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride has a molecular weight of 3316.99 g/mol, XLogP of 20.42, 11 rotatable bonds, 8 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;2-amino-4-bromo-5-chlorobenzamide;2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-2,6-dichloro-3H-quinazolin-4-one;tert-butyl 4-(7-bromo-6-chloro-2-fluoroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(3-iodo-6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[6-chloro-2-fluoro-7-(6-methyl-2-pyridinyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;methyl 2,2-difluoro-2-fluorosulfonylacetate;(6-methyl-2-pyridinyl)boronic acid;fluoride is sourced from PubChem (CID 162259606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).