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

C152H171Cl15F6N48O24 — CID 159236706

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

tert-butyl N-[2-(5-amino-2-methylanilino)-5-chloropyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl 3-[(2,5-dichloropyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;1-[3-[[5-chloro-4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]-4-methylphenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]urea;2,5-dichloro-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;2,4,5-trichloropyrimidine;hydrochloride (PubChem CID 159236706) has the molecular formula C152H171Cl15F6N48O24 and a molecular weight of 3700.13 g/mol. Its IUPAC name is tert-butyl N-[2-(5-amino-2-methylanilino)-5-chloropyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl 3-[(2,5-dichloropyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;1-[3-[[5-chloro-4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]-4-methylphenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]urea;2,5-dichloro-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;2,4,5-trichloropyrimidine;hydrochloride.

Molecular Properties

• Compound Name: tert-butyl N-[2-(5-amino-2-methylanilino)-5-chloropyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl 3-[(2,5-dichloropyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;1-[3-[[5-chloro-4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]-4-methylphenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]urea;2,5-dichloro-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;2,4,5-trichloropyrimidine;hydrochloride
• PubChem CID: 159236706
• Molecular Formula: C152H171Cl15F6N48O24
• Molecular Weight: 3700.13 g/mol
• Exact Mass: 3690.89
• IUPAC Name: tert-butyl N-[2-(5-amino-2-methylanilino)-5-chloropyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl 3-[(2,5-dichloropyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;1-[3-[[5-chloro-4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]-4-methylphenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]urea;2,5-dichloro-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;2,4,5-trichloropyrimidine;hydrochloride
• SMILES: CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CO.CO.Cc1cc(N(C(=O)OC(C)(C)C)c2nc(Cl)ncc2Cl)nn1C(=O)OC(C)(C)C.Cc1cc(N(C(=O)OC(C)(C)C)c2nc(Nc3cc(N)ccc3C)ncc2Cl)n[nH]1.Cc1cc(N(C(=O)OC(C)(C)C)c2nc(Nc3cc(NC(=O)Nc4ccc(Cl)c(C(F)(F)F)c4)ccc3C)ncc2Cl)n[nH]1.Cc1cc(N(C(=O)OC(C)(C)C)c2nc(Nc3cc([N+](=O)[O-])ccc3C)ncc2Cl)n[nH]1.Cc1cc(N)n[nH]1.Cc1cc(N=C=O)ccc1Cl.Cc1cc(Nc2nc(Cl)ncc2Cl)n[nH]1.Cc1cc(Nc2nc(Nc3cc(NC(=O)Nc4ccc(Cl)c(C(F)(F)F)c4)ccc3C)ncc2Cl)n[nH]1.Cc1ccc([N+](=O)[O-])cc1N.Cl.Clc1ncc(Cl)c(Cl)n1
• InChI: InChI=1S/C28H27Cl2F3N8O3.C23H19Cl2F3N8O.C20H22ClN7O4.C20H24ClN7O2.C18H23Cl2N5O4.C10H18O5.C8H7Cl2N5.C8H6ClNO.C7H8N2O2.C4HCl3N2.C4H7N3.2CH4O.ClH/c1-14-6-7-17(36-25(42)35-16-8-9-19(29)18(11-16)28(31,32)33)12-21(14)37-24-34-13-20(30)23(38-24)41(22-10-15(2)39-40-22)26(43)44-27(3,4)5;1-11-3-4-14(31-22(37)30-13-5-6-16(24)15(8-13)23(26,27)28)9-18(11)32-21-29-10-17(25)20(34-21)33-19-7-12(2)35-36-19;1-11-6-7-13(28(30)31)9-15(11)23-18-22-10-14(21)17(24-18)27(16-8-12(2)25-26-16)19(29)32-20(3,4)5;1-11-6-7-13(22)9-15(11)24-18-23-10-14(21)17(25-18)28(16-8-12(2)26-27-16)19(29)30-20(3,4)5;1-10-8-12(23-25(10)16(27)29-18(5,6)7)24(15(26)28-17(2,3)4)13-11(19)9-21-14(20)22-13;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;1-4-2-6(15-14-4)12-7-5(9)3-11-8(10)13-7;1-6-4-7(10-5-11)2-3-8(6)9;1-5-2-3-6(9(10)11)4-7(5)8;5-2-1-8-4(7)9-3(2)6;1-3-2-4(5)7-6-3;2*1-2;/h6-13H,1-5H3,(H,39,40)(H,34,37,38)(H2,35,36,42);3-10H,1-2H3,(H2,30,31,37)(H3,29,32,33,34,35,36);6-10H,1-5H3,(H,25,26)(H,22,23,24);6-10H,22H2,1-5H3,(H,26,27)(H,23,24,25);8-9H,1-7H3;1-6H3;2-3H,1H3,(H2,11,12,13,14,15);2-4H,1H3;2-4H,8H2,1H3;1H;2H,1H3,(H3,5,6,7);2*2H,1H3;1H
• InChIKey: PGOSWVAIWAJKCY-UHFFFAOYSA-N
• XLogP: 42.99
• TPSA: 965.32 Ų
• H-Bond Donors: 21
• H-Bond Acceptors: 56
• Rotatable Bonds: 27
• Heavy Atoms: 245
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3700.13
LogP ≤ 5	42.99
H-Bond Donors ≤ 5	21
H-Bond Acceptors ≤ 10	56

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 N-[2-(5-amino-2-methylanilino)-5-chloropyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl 3-[(2,5-dichloropyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;1-[3-[[5-chloro-4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]-4-methylphenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]urea;2,5-dichloro-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;2,4,5-trichloropyrimidine;hydrochloride?

The IUPAC name of tert-butyl N-[2-(5-amino-2-methylanilino)-5-chloropyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl 3-[(2,5-dichloropyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;1-[3-[[5-chloro-4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]-4-methylphenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]urea;2,5-dichloro-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;2,4,5-trichloropyrimidine;hydrochloride (CID 159236706) is tert-butyl N-[2-(5-amino-2-methylanilino)-5-chloropyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl 3-[(2,5-dichloropyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;1-[3-[[5-chloro-4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]-4-methylphenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]urea;2,5-dichloro-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;2,4,5-trichloropyrimidine;hydrochloride.

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

The canonical SMILES for tert-butyl N-[2-(5-amino-2-methylanilino)-5-chloropyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl 3-[(2,5-dichloropyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;1-[3-[[5-chloro-4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]-4-methylphenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]urea;2,5-dichloro-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;2,4,5-trichloropyrimidine;hydrochloride is CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CO.CO.Cc1cc(N(C(=O)OC(C)(C)C)c2nc(Cl)ncc2Cl)nn1C(=O)OC(C)(C)C.Cc1cc(N(C(=O)OC(C)(C)C)c2nc(Nc3cc(N)ccc3C)ncc2Cl)n[nH]1.Cc1cc(N(C(=O)OC(C)(C)C)c2nc(Nc3cc(NC(=O)Nc4ccc(Cl)c(C(F)(F)F)c4)ccc3C)ncc2Cl)n[nH]1.Cc1cc(N(C(=O)OC(C)(C)C)c2nc(Nc3cc([N+](=O)[O-])ccc3C)ncc2Cl)n[nH]1.Cc1cc(N)n[nH]1.Cc1cc(N=C=O)ccc1Cl.Cc1cc(Nc2nc(Cl)ncc2Cl)n[nH]1.Cc1cc(Nc2nc(Nc3cc(NC(=O)Nc4ccc(Cl)c(C(F)(F)F)c4)ccc3C)ncc2Cl)n[nH]1.Cc1ccc([N+](=O)[O-])cc1N.Cl.Clc1ncc(Cl)c(Cl)n1.

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

The InChIKey is PGOSWVAIWAJKCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H27Cl2F3N8O3.C23H19Cl2F3N8O.C20H22ClN7O4.C20H24ClN7O2.C18H23Cl2N5O4.C10H18O5.C8H7Cl2N5.C8H6ClNO.C7H8N2O2.C4HCl3N2.C4H7N3.2CH4O.ClH/c1-14-6-7-17(36-25(42)35-16-8-9-19(29)18(11-16)28(31,32)33)12-21(14)37-24-34-13-20(30)23(38-24)41(22-10-15(2)39-40-22)26(43)44-27(3,4)5;1-11-3-4-14(31-22(37)30-13-5-6-16(24)15(8-13)23(26,27)28)9-18(11)32-21-29-10-17(25)20(34-21)33-19-7-12(2)35-36-19;1-11-6-7-13(28(30)31)9-15(11)23-18-22-10-14(21)17(24-18)27(16-8-12(2)25-26-16)19(29)32-20(3,4)5;1-11-6-7-13(22)9-15(11)24-18-23-10-14(21)17(25-18)28(16-8-12(2)26-27-16)19(29)30-20(3,4)5;1-10-8-12(23-25(10)16(27)29-18(5,6)7)24(15(26)28-17(2,3)4)13-11(19)9-21-14(20)22-13;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;1-4-2-6(15-14-4)12-7-5(9)3-11-8(10)13-7;1-6-4-7(10-5-11)2-3-8(6)9;1-5-2-3-6(9(10)11)4-7(5)8;5-2-1-8-4(7)9-3(2)6;1-3-2-4(5)7-6-3;2*1-2;/h6-13H,1-5H3,(H,39,40)(H,34,37,38)(H2,35,36,42);3-10H,1-2H3,(H2,30,31,37)(H3,29,32,33,34,35,36);6-10H,1-5H3,(H,25,26)(H,22,23,24);6-10H,22H2,1-5H3,(H,26,27)(H,23,24,25);8-9H,1-7H3;1-6H3;2-3H,1H3,(H2,11,12,13,14,15);2-4H,1H3;2-4H,8H2,1H3;1H;2H,1H3,(H3,5,6,7);2*2H,1H3;1H.

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

tert-butyl N-[2-(5-amino-2-methylanilino)-5-chloropyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl 3-[(2,5-dichloropyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;1-[3-[[5-chloro-4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]-4-methylphenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]urea;2,5-dichloro-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;2,4,5-trichloropyrimidine;hydrochloride has a molecular weight of 3700.13 g/mol, XLogP of 42.99, 27 rotatable bonds, 21 hydrogen bond donors, and 56 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl N-[2-(5-amino-2-methylanilino)-5-chloropyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylanilino]pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl N-[5-chloro-2-(2-methyl-5-nitroanilino)pyrimidin-4-yl]-N-(5-methyl-1H-pyrazol-3-yl)carbamate;tert-butyl 3-[(2,5-dichloropyrimidin-4-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyrazole-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-chloro-4-isocyanato-2-methylbenzene;1-[3-[[5-chloro-4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]-4-methylphenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]urea;2,5-dichloro-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine;methanol;2-methyl-5-nitroaniline;5-methyl-1H-pyrazol-3-amine;2,4,5-trichloropyrimidine;hydrochloride is sourced from PubChem (CID 159236706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).