1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

C185H249B3Br4F12N42O38 — CID 159683940

About 1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (PubChem CID 159683940) has the molecular formula C185H249B3Br4F12N42O38 and a molecular weight of 4249.31 g/mol. Its IUPAC name is 1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.

Molecular Properties

• Compound Name: 1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
• PubChem CID: 159683940
• Molecular Formula: C185H249B3Br4F12N42O38
• Molecular Weight: 4249.31 g/mol
• Exact Mass: 4243.57
• IUPAC Name: 1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
• SMILES: CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1ncc2cc(B(O)O)ccc2n1.CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1ncc2cc(Br)ccc2n1.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CN(CCN)Cc1ccc(NC(=O)Nc2cc(-c3ccc4nc(N)ncc4c3)[nH]n2)cc1C(F)(F)F.CN(CCNC(=O)OC(C)(C)C)Cc1ccc(N)cc1C(F)(F)F.CN(CCNC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1C(F)(F)F.CNCCNC(=O)OC(C)(C)C.Cn1nc(N)cc1-c1ccc2nc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)ncc2c1.Cn1nc(N)cc1-c1ccc2nc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)ncc2c1.Cn1nc(N)cc1Br.Nc1ncc2cc(Br)ccc2n1.O=[N+]([O-])c1ccc(CBr)c(C(F)(F)F)c1
• InChI: InChI=1S/C23H24F3N9O.2C22H28N6O4.C18H24BN3O6.C18H22BrN3O4.C16H22F3N3O4.C16H24F3N3O2.C12H24B2O4.C10H18O5.C8H5BrF3NO2.C8H6BrN3.C8H18N2O2.C4H6BrN3/c1-35(7-6-27)12-14-2-4-16(9-17(14)23(24,25)26)30-22(36)32-20-10-19(33-34-20)13-3-5-18-15(8-13)11-29-21(28)31-18;2*1-21(2,3)31-19(29)28(20(30)32-22(4,5)6)18-24-12-14-10-13(8-9-15(14)25-18)16-11-17(23)26-27(16)7;1-17(2,3)27-15(23)22(16(24)28-18(4,5)6)14-20-10-11-9-12(19(25)26)7-8-13(11)21-14;1-17(2,3)25-15(23)22(16(24)26-18(4,5)6)14-20-10-11-9-12(19)7-8-13(11)21-14;1-15(2,3)26-14(23)20-7-8-21(4)10-11-5-6-12(22(24)25)9-13(11)16(17,18)19;1-15(2,3)24-14(23)21-7-8-22(4)10-11-5-6-12(20)9-13(11)16(17,18)19;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;9-4-5-1-2-6(13(14)15)3-7(5)8(10,11)12;9-6-1-2-7-5(3-6)4-11-8(10)12-7;1-8(2,3)12-7(11)10-6-5-9-4;1-8-3(5)2-4(6)7-8/h2-5,8-11H,6-7,12,27H2,1H3,(H2,28,29,31)(H3,30,32,33,34,36);2*8-12H,1-7H3,(H2,23,26);7-10,25-26H,1-6H3;7-10H,1-6H3;5-6,9H,7-8,10H2,1-4H3,(H,20,23);5-6,9H,7-8,10,20H2,1-4H3,(H,21,23);1-8H3;1-6H3;1-3H,4H2;1-4H,(H2,10,11,12);9H,5-6H2,1-4H3,(H,10,11);2H,1H3,(H2,6,7)
• InChIKey: MVNXUPVSIUYQEF-UHFFFAOYSA-N
• XLogP: 38.20
• TPSA: 1045.68 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 68
• Rotatable Bonds: 31
• Heavy Atoms: 284
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4249.31
LogP ≤ 5	38.20
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	68

Frequently Asked Questions

What is the IUPAC name of 1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The IUPAC name of 1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (CID 159683940) is 1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.

What is the SMILES notation for 1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The canonical SMILES for 1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1ncc2cc(B(O)O)ccc2n1.CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1ncc2cc(Br)ccc2n1.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CN(CCN)Cc1ccc(NC(=O)Nc2cc(-c3ccc4nc(N)ncc4c3)[nH]n2)cc1C(F)(F)F.CN(CCNC(=O)OC(C)(C)C)Cc1ccc(N)cc1C(F)(F)F.CN(CCNC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1C(F)(F)F.CNCCNC(=O)OC(C)(C)C.Cn1nc(N)cc1-c1ccc2nc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)ncc2c1.Cn1nc(N)cc1-c1ccc2nc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)ncc2c1.Cn1nc(N)cc1Br.Nc1ncc2cc(Br)ccc2n1.O=[N+]([O-])c1ccc(CBr)c(C(F)(F)F)c1.

What is the InChIKey of 1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The InChIKey is MVNXUPVSIUYQEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24F3N9O.2C22H28N6O4.C18H24BN3O6.C18H22BrN3O4.C16H22F3N3O4.C16H24F3N3O2.C12H24B2O4.C10H18O5.C8H5BrF3NO2.C8H6BrN3.C8H18N2O2.C4H6BrN3/c1-35(7-6-27)12-14-2-4-16(9-17(14)23(24,25)26)30-22(36)32-20-10-19(33-34-20)13-3-5-18-15(8-13)11-29-21(28)31-18;2*1-21(2,3)31-19(29)28(20(30)32-22(4,5)6)18-24-12-14-10-13(8-9-15(14)25-18)16-11-17(23)26-27(16)7;1-17(2,3)27-15(23)22(16(24)28-18(4,5)6)14-20-10-11-9-12(19(25)26)7-8-13(11)21-14;1-17(2,3)25-15(23)22(16(24)26-18(4,5)6)14-20-10-11-9-12(19)7-8-13(11)21-14;1-15(2,3)26-14(23)20-7-8-21(4)10-11-5-6-12(22(24)25)9-13(11)16(17,18)19;1-15(2,3)24-14(23)21-7-8-22(4)10-11-5-6-12(20)9-13(11)16(17,18)19;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;9-4-5-1-2-6(13(14)15)3-7(5)8(10,11)12;9-6-1-2-7-5(3-6)4-11-8(10)12-7;1-8(2,3)12-7(11)10-6-5-9-4;1-8-3(5)2-4(6)7-8/h2-5,8-11H,6-7,12,27H2,1H3,(H2,28,29,31)(H3,30,32,33,34,36);2*8-12H,1-7H3,(H2,23,26);7-10,25-26H,1-6H3;7-10H,1-6H3;5-6,9H,7-8,10H2,1-4H3,(H,20,23);5-6,9H,7-8,10,20H2,1-4H3,(H,21,23);1-8H3;1-6H3;1-3H,4H2;1-4H,(H2,10,11,12);9H,5-6H2,1-4H3,(H,10,11);2H,1H3,(H2,6,7).

What are the key properties of 1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane has a molecular weight of 4249.31 g/mol, XLogP of 38.20, 31 rotatable bonds, 16 hydrogen bond donors, and 68 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-[[2-aminoethyl(methyl)amino]methyl]-3-(trifluoromethyl)phenyl]-3-[5-(2-aminoquinazolin-6-yl)-1H-pyrazol-3-yl]urea;[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]quinazolin-6-yl]boronic acid;1-(bromomethyl)-4-nitro-2-(trifluoromethyl)benzene;5-bromo-1-methylpyrazol-3-amine;6-bromoquinazolin-2-amine;bis(tert-butyl N-[6-(3-amino-1-methylpyrazol-5-yl)quinazolin-2-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate);tert-butyl N-[2-[[4-amino-2-(trifluoromethyl)phenyl]methyl-methylamino]ethyl]carbamate;tert-butyl N-(6-bromoquinazolin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[2-(methylamino)ethyl]carbamate;tert-butyl N-[2-[methyl-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]amino]ethyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is sourced from PubChem (CID 159683940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).