tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride

C145H186Cl7F3N40O27 — CID 158900930

About tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride

tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride (PubChem CID 158900930) has the molecular formula C145H186Cl7F3N40O27 and a molecular weight of 3226.50 g/mol. Its IUPAC name is tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride.

Molecular Properties

• Compound Name: tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride
• PubChem CID: 158900930
• Molecular Formula: C145H186Cl7F3N40O27
• Molecular Weight: 3226.50 g/mol
• Exact Mass: 3221.22
• IUPAC Name: tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride
• SMILES: CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CO.CO.Cc1cc(N)n[nH]1.Cc1cc(N=C=O)ccc1Cl.Cc1cc(Nc2nc(Cl)ncc2C)n[nH]1.Cc1ccc(N)cc1Nc1ncc(C)c(N(C(=O)OC(C)(C)C)c2cc(C)n(C(=O)OC(C)(C)C)n2)n1.Cc1ccc(NC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1Nc1ncc(C)c(Nc2cc(C)n(C(=O)OC(C)(C)C)n2)n1.Cc1ccc([N+](=O)[O-])cc1N.Cc1ccc([N+](=O)[O-])cc1Nc1ncc(C)c(N(C(=O)OC(C)(C)C)c2cc(C)n(C(=O)OC(C)(C)C)n2)n1.Cc1cnc(Cl)nc1Cl.Cc1cnc(Cl)nc1N(C(=O)OC(C)(C)C)c1cc(C)n(C(=O)OC(C)(C)C)n1.Cl
• InChI: InChI=1S/C29H30ClF3N8O3.C26H33N7O6.C26H35N7O4.C19H26ClN5O4.C10H18O5.C9H10ClN5.C8H6ClNO.C7H8N2O2.C5H4Cl2N2.C4H7N3.2CH4O.ClH/c1-15-7-8-19(36-26(42)35-18-9-10-21(30)20(12-18)29(31,32)33)13-22(15)37-25-34-14-16(2)24(39-25)38-23-11-17(3)41(40-23)27(43)44-28(4,5)6;1-15-10-11-18(33(36)37)13-19(15)28-22-27-14-16(2)21(29-22)31(23(34)38-25(4,5)6)20-12-17(3)32(30-20)24(35)39-26(7,8)9;1-15-10-11-18(27)13-19(15)29-22-28-14-16(2)21(30-22)32(23(34)36-25(4,5)6)20-12-17(3)33(31-20)24(35)37-26(7,8)9;1-11-10-21-15(20)22-14(11)24(16(26)28-18(3,4)5)13-9-12(2)25(23-13)17(27)29-19(6,7)8;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;1-5-4-11-9(10)13-8(5)12-7-3-6(2)14-15-7;1-6-4-7(10-5-11)2-3-8(6)9;1-5-2-3-6(9(10)11)4-7(5)8;1-3-2-8-5(7)9-4(3)6;1-3-2-4(5)7-6-3;2*1-2;/h7-14H,1-6H3,(H2,35,36,42)(H2,34,37,38,39,40);10-14H,1-9H3,(H,27,28,29);10-14H,27H2,1-9H3,(H,28,29,30);9-10H,1-8H3;1-6H3;3-4H,1-2H3,(H2,11,12,13,14,15);2-4H,1H3;2-4H,8H2,1H3;2H,1H3;2H,1H3,(H3,5,6,7);2*2H,1H3;1H
• InChIKey: BXOHNSOPDZBUKY-UHFFFAOYSA-N
• XLogP: 36.09
• TPSA: 874.48 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 58
• Rotatable Bonds: 21
• Heavy Atoms: 222
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3226.50
LogP ≤ 5	36.09
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	58

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isocyanate', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride?

The IUPAC name of tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride (CID 158900930) is tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride.

What is the SMILES notation for tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride?

The canonical SMILES for tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride is CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CO.CO.Cc1cc(N)n[nH]1.Cc1cc(N=C=O)ccc1Cl.Cc1cc(Nc2nc(Cl)ncc2C)n[nH]1.Cc1ccc(N)cc1Nc1ncc(C)c(N(C(=O)OC(C)(C)C)c2cc(C)n(C(=O)OC(C)(C)C)n2)n1.Cc1ccc(NC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1Nc1ncc(C)c(Nc2cc(C)n(C(=O)OC(C)(C)C)n2)n1.Cc1ccc([N+](=O)[O-])cc1N.Cc1ccc([N+](=O)[O-])cc1Nc1ncc(C)c(N(C(=O)OC(C)(C)C)c2cc(C)n(C(=O)OC(C)(C)C)n2)n1.Cc1cnc(Cl)nc1Cl.Cc1cnc(Cl)nc1N(C(=O)OC(C)(C)C)c1cc(C)n(C(=O)OC(C)(C)C)n1.Cl.

What is the InChIKey of tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride?

The InChIKey is BXOHNSOPDZBUKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H30ClF3N8O3.C26H33N7O6.C26H35N7O4.C19H26ClN5O4.C10H18O5.C9H10ClN5.C8H6ClNO.C7H8N2O2.C5H4Cl2N2.C4H7N3.2CH4O.ClH/c1-15-7-8-19(36-26(42)35-18-9-10-21(30)20(12-18)29(31,32)33)13-22(15)37-25-34-14-16(2)24(39-25)38-23-11-17(3)41(40-23)27(43)44-28(4,5)6;1-15-10-11-18(33(36)37)13-19(15)28-22-27-14-16(2)21(29-22)31(23(34)38-25(4,5)6)20-12-17(3)32(30-20)24(35)39-26(7,8)9;1-15-10-11-18(27)13-19(15)29-22-28-14-16(2)21(30-22)32(23(34)36-25(4,5)6)20-12-17(3)33(31-20)24(35)37-26(7,8)9;1-11-10-21-15(20)22-14(11)24(16(26)28-18(3,4)5)13-9-12(2)25(23-13)17(27)29-19(6,7)8;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;1-5-4-11-9(10)13-8(5)12-7-3-6(2)14-15-7;1-6-4-7(10-5-11)2-3-8(6)9;1-5-2-3-6(9(10)11)4-7(5)8;1-3-2-8-5(7)9-4(3)6;1-3-2-4(5)7-6-3;2*1-2;/h7-14H,1-6H3,(H2,35,36,42)(H2,34,37,38,39,40);10-14H,1-9H3,(H,27,28,29);10-14H,27H2,1-9H3,(H,28,29,30);9-10H,1-8H3;1-6H3;3-4H,1-2H3,(H2,11,12,13,14,15);2-4H,1H3;2-4H,8H2,1H3;2H,1H3;2H,1H3,(H3,5,6,7);2*2H,1H3;1H.

What are the key properties of tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride?

tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride has a molecular weight of 3226.50 g/mol, XLogP of 36.09, 21 rotatable bonds, 14 hydrogen bond donors, and 58 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl 3-[[2-(5-amino-2-methylanilino)-5-methylpyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[(2-chloro-5-methylpyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 3-[[2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]-5-methylpyrimidin-4-yl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl 5-methyl-3-[[5-methyl-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;2-chloro-5-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;2,4-dichloro-5-methylpyrimidine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;hydrochloride is sourced from PubChem (CID 158900930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).