benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol

C126H149ClF6N40O2 — CID 158678145

IUPACbenzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol
SMILESCC(Nc1nc(NC2=NCC(C3CC3)=C2)nc(N2CCN(C)CC2)n1)c1ccc(F)cc1.CC(Nc1nc(NC2=NCC(c3ccc(Cl)cc3)=C2)nc(N2CCN(C)CC2)n1)c1ccc(F)cc1.CC(Nc1nc(NC2=NCC(c3ccc(F)cc3)=C2)nc(N2CCN(C)CC2)n1)c1ccc(F)cc1.CC(Nc1nc(NC2=NCC(c3ccco3)=C2)nc(N2CCN(C)CC2)n1)c1ccc(F)cc1.CCN(CCNC)c1nc(NC2=NCC=C2)nc(NC(C)c2ccc(F)cc2)n1.CO.c1ccccc1
InChIInChI=1S/C26H28ClFN8.C26H28F2N8.C24H27FN8O.C23H29FN8.C20H27FN8.C6H6.CH4O/c1-17(18-5-9-22(28)10-6-18)30-24-32-25(34-26(33-24)36-13-11-35(2)12-14-36)31-23-15-20(16-29-23)19-3-7-21(27)8-4-19;1-17(18-3-7-21(27)8-4-18)30-24-32-25(34-26(33-24)36-13-11-35(2)12-14-36)31-23-15-20(16-29-23)19-5-9-22(28)10-6-19;1-16(17-5-7-19(25)8-6-17)27-22-29-23(31-24(30-22)33-11-9-32(2)10-12-33)28-21-14-18(15-26-21)20-4-3-13-34-20;1-15(16-5-7-19(24)8-6-16)26-21-28-22(27-20-13-18(14-25-20)17-3-4-17)30-23(29-21)32-11-9-31(2)10-12-32;1-4-29(13-12-22-3)20-27-18(24-14(2)15-7-9-16(21)10-8-15)26-19(28-20)25-17-6-5-11-23-17;1-2-4-6-5-3-1;1-2/h2*3-10,15,17H,11-14,16H2,1-2H3,(H2,29,30,31,32,33,34);3-8,13-14,16H,9-12,15H2,1-2H3,(H2,26,27,28,29,30,31);5-8,13,15,17H,3-4,9-12,14H2,1-2H3,(H2,25,26,27,28,29,30);5-10,14,22H,4,11-13H2,1-3H3,(H2,23,24,25,26,27,28);1-6H;2H,1H3
InChIKeyIETYPCBTTKXLTG-UHFFFAOYSA-N
MW2405.30 g/mol
LogP18.92
Rot. Bonds33

About benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol

benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol (PubChem CID 158678145) has the molecular formula C126H149ClF6N40O2 and a molecular weight of 2405.30 g/mol. Its IUPAC name is benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol.

Molecular Properties

Compound Namebenzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol
PubChem CID158678145
Molecular FormulaC126H149ClF6N40O2
Molecular Weight2405.30 g/mol
Exact Mass2403.24
IUPAC Namebenzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol
SMILESCC(Nc1nc(NC2=NCC(C3CC3)=C2)nc(N2CCN(C)CC2)n1)c1ccc(F)cc1.CC(Nc1nc(NC2=NCC(c3ccc(Cl)cc3)=C2)nc(N2CCN(C)CC2)n1)c1ccc(F)cc1.CC(Nc1nc(NC2=NCC(c3ccc(F)cc3)=C2)nc(N2CCN(C)CC2)n1)c1ccc(F)cc1.CC(Nc1nc(NC2=NCC(c3ccco3)=C2)nc(N2CCN(C)CC2)n1)c1ccc(F)cc1.CCN(CCNC)c1nc(NC2=NCC=C2)nc(NC(C)c2ccc(F)cc2)n1.CO.c1ccccc1
InChIInChI=1S/C26H28ClFN8.C26H28F2N8.C24H27FN8O.C23H29FN8.C20H27FN8.C6H6.CH4O/c1-17(18-5-9-22(28)10-6-18)30-24-32-25(34-26(33-24)36-13-11-35(2)12-14-36)31-23-15-20(16-29-23)19-3-7-21(27)8-4-19;1-17(18-3-7-21(27)8-4-18)30-24-32-25(34-26(33-24)36-13-11-35(2)12-14-36)31-23-15-20(16-29-23)19-5-9-22(28)10-6-19;1-16(17-5-7-19(25)8-6-17)27-22-29-23(31-24(30-22)33-11-9-32(2)10-12-33)28-21-14-18(15-26-21)20-4-3-13-34-20;1-15(16-5-7-19(24)8-6-16)26-21-28-22(27-20-13-18(14-25-20)17-3-4-17)30-23(29-21)32-11-9-31(2)10-12-32;1-4-29(13-12-22-3)20-27-18(24-14(2)15-7-9-16(21)10-8-15)26-19(28-20)25-17-6-5-11-23-17;1-2-4-6-5-3-1;1-2/h2*3-10,15,17H,11-14,16H2,1-2H3,(H2,29,30,31,32,33,34);3-8,13-14,16H,9-12,15H2,1-2H3,(H2,26,27,28,29,30,31);5-8,13,15,17H,3-4,9-12,14H2,1-2H3,(H2,25,26,27,28,29,30);5-10,14,22H,4,11-13H2,1-3H3,(H2,23,24,25,26,27,28);1-6H;2H,1H3
InChIKeyIETYPCBTTKXLTG-UHFFFAOYSA-N
XLogP18.92
TPSA450.01 Ų
H-Bond Donors12
H-Bond Acceptors42
Rotatable Bonds33
Heavy Atoms175
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002405.30
LogP ≤ 518.92
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1042

Analyze benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol with MolForge

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Frequently Asked Questions

What is the IUPAC name of benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol?
The IUPAC name of benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol (CID 158678145) is benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol.
What is the SMILES notation for benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol?
The canonical SMILES for benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol is CC(Nc1nc(NC2=NCC(C3CC3)=C2)nc(N2CCN(C)CC2)n1)c1ccc(F)cc1.CC(Nc1nc(NC2=NCC(c3ccc(Cl)cc3)=C2)nc(N2CCN(C)CC2)n1)c1ccc(F)cc1.CC(Nc1nc(NC2=NCC(c3ccc(F)cc3)=C2)nc(N2CCN(C)CC2)n1)c1ccc(F)cc1.CC(Nc1nc(NC2=NCC(c3ccco3)=C2)nc(N2CCN(C)CC2)n1)c1ccc(F)cc1.CCN(CCNC)c1nc(NC2=NCC=C2)nc(NC(C)c2ccc(F)cc2)n1.CO.c1ccccc1.
What is the InChIKey of benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol?
The InChIKey is IETYPCBTTKXLTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28ClFN8.C26H28F2N8.C24H27FN8O.C23H29FN8.C20H27FN8.C6H6.CH4O/c1-17(18-5-9-22(28)10-6-18)30-24-32-25(34-26(33-24)36-13-11-35(2)12-14-36)31-23-15-20(16-29-23)19-3-7-21(27)8-4-19;1-17(18-3-7-21(27)8-4-18)30-24-32-25(34-26(33-24)36-13-11-35(2)12-14-36)31-23-15-20(16-29-23)19-5-9-22(28)10-6-19;1-16(17-5-7-19(25)8-6-17)27-22-29-23(31-24(30-22)33-11-9-32(2)10-12-33)28-21-14-18(15-26-21)20-4-3-13-34-20;1-15(16-5-7-19(24)8-6-16)26-21-28-22(27-20-13-18(14-25-20)17-3-4-17)30-23(29-21)32-11-9-31(2)10-12-32;1-4-29(13-12-22-3)20-27-18(24-14(2)15-7-9-16(21)10-8-15)26-19(28-20)25-17-6-5-11-23-17;1-2-4-6-5-3-1;1-2/h2*3-10,15,17H,11-14,16H2,1-2H3,(H2,29,30,31,32,33,34);3-8,13-14,16H,9-12,15H2,1-2H3,(H2,26,27,28,29,30,31);5-8,13,15,17H,3-4,9-12,14H2,1-2H3,(H2,25,26,27,28,29,30);5-10,14,22H,4,11-13H2,1-3H3,(H2,23,24,25,26,27,28);1-6H;2H,1H3.
What are the key properties of benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol?
benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol has a molecular weight of 2405.30 g/mol, XLogP of 18.92, 33 rotatable bonds, 12 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;4-N-[3-(4-chlorophenyl)-2H-pyrrol-5-yl]-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;4-N-(3-cyclopropyl-2H-pyrrol-5-yl)-2-N-[1-(4-fluorophenyl)ethyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-ethyl-4-N-[1-(4-fluorophenyl)ethyl]-2-N-[2-(methylamino)ethyl]-6-N-(2H-pyrrol-5-yl)-1,3,5-triazine-2,4,6-triamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[3-(furan-2-yl)-2H-pyrrol-5-yl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine;methanol is sourced from PubChem (CID 158678145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).