4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine

C75H91BrClF9N24O9 — CID 158749748

IUPAC4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine
SMILESCOc1ccc(Cl)cc1CNc1ncc([N+](=O)[O-])c(NCC2CCC(N)CC2)n1.NC1CCC(CNc2nc(NCc3ccc(Br)cc3F)ncc2[N+](=O)[O-])CC1.NC1CCC(CNc2nc(NCc3ccc(F)c(C(F)(F)F)c3)ncc2[N+](=O)[O-])CC1.NC1CCC(CNc2nc(NCc3ccc(F)cc3C(F)(F)F)ncc2[N+](=O)[O-])CC1
InChIInChI=1S/C19H25ClN6O3.2C19H22F4N6O2.C18H22BrFN6O2/c1-29-17-7-4-14(20)8-13(17)10-23-19-24-11-16(26(27)28)18(25-19)22-9-12-2-5-15(21)6-3-12;20-13-4-3-12(15(7-13)19(21,22)23)9-26-18-27-10-16(29(30)31)17(28-18)25-8-11-1-5-14(24)6-2-11;20-15-6-3-12(7-14(15)19(21,22)23)9-26-18-27-10-16(29(30)31)17(28-18)25-8-11-1-4-13(24)5-2-11;19-13-4-3-12(15(20)7-13)9-23-18-24-10-16(26(27)28)17(25-18)22-8-11-1-5-14(21)6-2-11/h4,7-8,11-12,15H,2-3,5-6,9-10,21H2,1H3,(H2,22,23,24,25);3-4,7,10-11,14H,1-2,5-6,8-9,24H2,(H2,25,26,27,28);3,6-7,10-11,13H,1-2,4-5,8-9,24H2,(H2,25,26,27,28);3-4,7,10-11,14H,1-2,5-6,8-9,21H2,(H2,22,23,24,25)
InChIKeyINIBXJGEPBIXCC-UHFFFAOYSA-N
MW1759.05 g/mol
LogP15.58
Rot. Bonds29

About 4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine

4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine (PubChem CID 158749748) has the molecular formula C75H91BrClF9N24O9 and a molecular weight of 1759.05 g/mol. Its IUPAC name is 4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine
PubChem CID158749748
Molecular FormulaC75H91BrClF9N24O9
Molecular Weight1759.05 g/mol
Exact Mass1756.61
IUPAC Name4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine
SMILESCOc1ccc(Cl)cc1CNc1ncc([N+](=O)[O-])c(NCC2CCC(N)CC2)n1.NC1CCC(CNc2nc(NCc3ccc(Br)cc3F)ncc2[N+](=O)[O-])CC1.NC1CCC(CNc2nc(NCc3ccc(F)c(C(F)(F)F)c3)ncc2[N+](=O)[O-])CC1.NC1CCC(CNc2nc(NCc3ccc(F)cc3C(F)(F)F)ncc2[N+](=O)[O-])CC1
InChIInChI=1S/C19H25ClN6O3.2C19H22F4N6O2.C18H22BrFN6O2/c1-29-17-7-4-14(20)8-13(17)10-23-19-24-11-16(26(27)28)18(25-19)22-9-12-2-5-15(21)6-3-12;20-13-4-3-12(15(7-13)19(21,22)23)9-26-18-27-10-16(29(30)31)17(28-18)25-8-11-1-5-14(24)6-2-11;20-15-6-3-12(7-14(15)19(21,22)23)9-26-18-27-10-16(29(30)31)17(28-18)25-8-11-1-4-13(24)5-2-11;19-13-4-3-12(15(20)7-13)9-23-18-24-10-16(26(27)28)17(25-18)22-8-11-1-5-14(21)6-2-11/h4,7-8,11-12,15H,2-3,5-6,9-10,21H2,1H3,(H2,22,23,24,25);3-4,7,10-11,14H,1-2,5-6,8-9,24H2,(H2,25,26,27,28);3,6-7,10-11,13H,1-2,4-5,8-9,24H2,(H2,25,26,27,28);3-4,7,10-11,14H,1-2,5-6,8-9,21H2,(H2,22,23,24,25)
InChIKeyINIBXJGEPBIXCC-UHFFFAOYSA-N
XLogP15.58
TPSA485.23 Ų
H-Bond Donors12
H-Bond Acceptors29
Rotatable Bonds29
Heavy Atoms119
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001759.05
LogP ≤ 515.58
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine with MolForge

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Related Compounds

4-N-[(4-aminocyclohexyl)methyl]-2-N-[[5-chloro-2-(trifluoromethoxy)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;2-N-[[5-chloro-2-(trifluoromethoxy)phenyl]methyl]-5-nitro-4-N-[(4-pyrrolidin-1-ylcyclohexyl)methyl]pyrimidine-2,4-diamine;1,4-dibromobutane;methane
CID 157060590
4-N-[(4-aminocyclohexyl)methyl]-2-N-[[5-chloro-2-(trifluoromethoxy)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;2-N-[[5-chloro-2-(trifluoromethoxy)phenyl]methyl]-5-nitro-4-N-[(4-pyrrolidin-1-ylcyclohexyl)methyl]pyrimidine-2,4-diamine;1,4-dibromobutane
CID 157627062
4-N-[(4-aminocyclohexyl)methyl]-2-N-[(3-chloro-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(3-chloro-2-methylphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(2,3-dimethylphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-5-nitro-2-N-[[3-(trifluoromethoxy)phenyl]methyl]pyrimidine-2,4-diamine
CID 158107142
4-N-[(4-aminocyclohexyl)methyl]-5-nitro-2-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrimidine-2,4-diamine;4-N-[[4-(benzylamino)cyclohexyl]methyl]-5-nitro-2-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrimidine-2,4-diamine;bromomethylbenzene;methane
CID 158204223
3-[[[4-[(4-aminocyclohexyl)methylamino]-5-nitropyrimidin-2-yl]amino]methyl]phenol;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine
CID 158608094
2-N-[(5-amino-2-chlorophenyl)methyl]-4-N-[(4-aminocyclohexyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(3-aminophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-amino-4-methylcyclohexyl)methyl]-5-nitro-2-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrimidine-2,4-diamine;2-N-[[3-(aminomethyl)phenyl]methyl]-5-nitro-4-N-[(4-pyrrolidin-1-ylcyclohexyl)methyl]pyrimidine-2,4-diamine
CID 158870621
4-N-[(4-aminocyclohexyl)methyl]-2-N-[(3-chlorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(3-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(3-methylphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-5-nitro-2-N-[[3-(trifluoromethoxy)phenyl]methyl]pyrimidine-2,4-diamine
CID 160460259
2-N-[(3-bromo-2-methylphenyl)methyl]-4-N-[[4-(2,2-difluoroethylamino)cyclohexyl]methyl]-5-nitropyrimidine-2,4-diamine;bis(4-N-[[4-(diethylamino)cyclohexyl]methyl]-5-nitro-2-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrimidine-2,4-diamine);4-[[4-(ethylamino)cyclohexyl]methylamino]-2-[[2-(trifluoromethoxy)phenyl]methylamino]pyrimidine-5-carbonitrile
CID 161227766
4-N-[(4-aminocyclohexyl)methyl]-2-N-[[5-chloro-2-(trifluoromethoxy)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(2-methoxy-3-pyridinyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-methoxy-3-pyridinyl)methyl]-5-nitropyrimidine-2,4-diamine;2-N-[[5-chloro-2-(trifluoromethoxy)phenyl]methyl]-5-nitro-4-N-[(4-pyrrolidin-1-ylcyclohexyl)methyl]pyrimidine-2,4-diamine
CID 161535244
3-[[[4-[(4-aminocyclohexyl)methylamino]-5-nitropyrimidin-2-yl]amino]methyl]phenol;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(2-chloro-3-pyridinyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-chloro-3-pyridinyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-fluoro-2-methylphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine
CID 160301196
4-N-[(4-aminocyclohexyl)methyl]-2-N-benzyl-5-chloropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-chloro-2-methylphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;cis-(1R,3R)-3-[[[4-[(4-aminocyclohexyl)methylamino]-5-nitropyrimidin-2-yl]amino]methyl]-4,4-dimethylcyclohexan-1-ol
CID 162017580

Frequently Asked Questions

What is the IUPAC name of 4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine?
The IUPAC name of 4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine (CID 158749748) is 4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine?
The canonical SMILES for 4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine is COc1ccc(Cl)cc1CNc1ncc([N+](=O)[O-])c(NCC2CCC(N)CC2)n1.NC1CCC(CNc2nc(NCc3ccc(Br)cc3F)ncc2[N+](=O)[O-])CC1.NC1CCC(CNc2nc(NCc3ccc(F)c(C(F)(F)F)c3)ncc2[N+](=O)[O-])CC1.NC1CCC(CNc2nc(NCc3ccc(F)cc3C(F)(F)F)ncc2[N+](=O)[O-])CC1.
What is the InChIKey of 4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine?
The InChIKey is INIBXJGEPBIXCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25ClN6O3.2C19H22F4N6O2.C18H22BrFN6O2/c1-29-17-7-4-14(20)8-13(17)10-23-19-24-11-16(26(27)28)18(25-19)22-9-12-2-5-15(21)6-3-12;20-13-4-3-12(15(7-13)19(21,22)23)9-26-18-27-10-16(29(30)31)17(28-18)25-8-11-1-5-14(24)6-2-11;20-15-6-3-12(7-14(15)19(21,22)23)9-26-18-27-10-16(29(30)31)17(28-18)25-8-11-1-4-13(24)5-2-11;19-13-4-3-12(15(20)7-13)9-23-18-24-10-16(26(27)28)17(25-18)22-8-11-1-5-14(21)6-2-11/h4,7-8,11-12,15H,2-3,5-6,9-10,21H2,1H3,(H2,22,23,24,25);3-4,7,10-11,14H,1-2,5-6,8-9,24H2,(H2,25,26,27,28);3,6-7,10-11,13H,1-2,4-5,8-9,24H2,(H2,25,26,27,28);3-4,7,10-11,14H,1-2,5-6,8-9,21H2,(H2,22,23,24,25).
What are the key properties of 4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine?
4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine has a molecular weight of 1759.05 g/mol, XLogP of 15.58, 29 rotatable bonds, 12 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[(4-aminocyclohexyl)methyl]-2-N-[(4-bromo-2-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[(5-chloro-2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine;4-N-[(4-aminocyclohexyl)methyl]-2-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-nitropyrimidine-2,4-diamine is sourced from PubChem (CID 158749748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).