4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen
C125H144Cl7F3N46O7 — CID 159925195
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAC4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen
SMILESCC(NC(=O)COc1ccc(-c2nc(Nc3ccc4[nH]ncc4c3Cl)n(C)n2)cc1)C(F)(F)F.CN1CCN(Cc2cccc(-c3nc(Nc4ccc5[nH]ncc5c4Cl)n(C)n3)c2)CC1.CN1CCc2cc(-c3nc(Nc4ccc5[nH]ncc5c4Cl)n(C)n3)ccc2C1=O.COc1ccc(-c2nc(Nc3ccc4[nH]ncc4c3Cl)n(C)n2)cc1.Cn1nc(-c2cccc(O)c2)nc1Nc1ccc2[nH]ncc2c1Cl.Cn1nc(-c2ccco2)nc1Nc1ccc2[nH]ncc2c1Cl.Cn1nc(C2=CCOCC2)nc1Nc1ccc2[nH]ncc2c1Cl.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C22H25ClN8.C21H19ClF3N7O2.C20H18ClN7O.C17H15ClN6O.C16H13ClN6O.C15H15ClN6O.C14H11ClN6O.14H2/c1-29-8-10-31(11-9-29)14-15-4-3-5-16(12-15)21-26-22(30(2)28-21)25-19-7-6-18-17(20(19)23)13-24-27-18;1-11(21(23,24)25)27-17(33)10-34-13-5-3-12(4-6-13)19-29-20(32(2)31-19)28-16-8-7-15-14(18(16)22)9-26-30-15;1-27-8-7-11-9-12(3-4-13(11)19(27)29)18-24-20(28(2)26-18)23-16-6-5-15-14(17(16)21)10-22-25-15;1-24-17(20-14-8-7-13-12(15(14)18)9-19-22-13)21-16(23-24)10-3-5-11(25-2)6-4-10;1-23-16(20-15(22-23)9-3-2-4-10(24)7-9)19-13-6-5-12-11(14(13)17)8-18-21-12;1-22-15(19-14(21-22)9-4-6-23-7-5-9)18-12-3-2-11-10(13(12)16)8-17-20-11;1-21-14(18-13(20-21)11-3-2-6-22-11)17-10-5-4-9-8(12(10)15)7-16-19-9;;;;;;;;;;;;;;/h3-7,12-13H,8-11,14H2,1-2H3,(H,24,27)(H,25,26,28);3-9,11H,10H2,1-2H3,(H,26,30)(H,27,33)(H,28,29,31);3-6,9-10H,7-8H2,1-2H3,(H,22,25)(H,23,24,26);3-9H,1-2H3,(H,19,22)(H,20,21,23);2-8,24H,1H3,(H,18,21)(H,19,20,22);2-4,8H,5-7H2,1H3,(H,17,20)(H,18,19,21);2-7H,1H3,(H,16,19)(H,17,18,20);14*1H
InChIKeyNYXRATURNMRXJJ-UHFFFAOYSA-N
MW2708.01 g/mol
LogP28.00
Rot. Bonds28
About 4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen
4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen (PubChem CID 159925195) has the molecular formula C125H144Cl7F3N46O7 and a molecular weight of 2708.01 g/mol. Its IUPAC name is 4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen.
Molecular Properties
| Compound Name | 4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen |
|---|---|
| PubChem CID | 159925195 |
| Molecular Formula | C125H144Cl7F3N46O7 |
| Molecular Weight | 2708.01 g/mol |
| Exact Mass | 2703.01 |
| IUPAC Name | 4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen |
| SMILES | CC(NC(=O)COc1ccc(-c2nc(Nc3ccc4[nH]ncc4c3Cl)n(C)n2)cc1)C(F)(F)F.CN1CCN(Cc2cccc(-c3nc(Nc4ccc5[nH]ncc5c4Cl)n(C)n3)c2)CC1.CN1CCc2cc(-c3nc(Nc4ccc5[nH]ncc5c4Cl)n(C)n3)ccc2C1=O.COc1ccc(-c2nc(Nc3ccc4[nH]ncc4c3Cl)n(C)n2)cc1.Cn1nc(-c2cccc(O)c2)nc1Nc1ccc2[nH]ncc2c1Cl.Cn1nc(-c2ccco2)nc1Nc1ccc2[nH]ncc2c1Cl.Cn1nc(C2=CCOCC2)nc1Nc1ccc2[nH]ncc2c1Cl.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H] |
| InChI | InChI=1S/C22H25ClN8.C21H19ClF3N7O2.C20H18ClN7O.C17H15ClN6O.C16H13ClN6O.C15H15ClN6O.C14H11ClN6O.14H2/c1-29-8-10-31(11-9-29)14-15-4-3-5-16(12-15)21-26-22(30(2)28-21)25-19-7-6-18-17(20(19)23)13-24-27-18;1-11(21(23,24)25)27-17(33)10-34-13-5-3-12(4-6-13)19-29-20(32(2)31-19)28-16-8-7-15-14(18(16)22)9-26-30-15;1-27-8-7-11-9-12(3-4-13(11)19(27)29)18-24-20(28(2)26-18)23-16-6-5-15-14(17(16)21)10-22-25-15;1-24-17(20-14-8-7-13-12(15(14)18)9-19-22-13)21-16(23-24)10-3-5-11(25-2)6-4-10;1-23-16(20-15(22-23)9-3-2-4-10(24)7-9)19-13-6-5-12-11(14(13)17)8-18-21-12;1-22-15(19-14(21-22)9-4-6-23-7-5-9)18-12-3-2-11-10(13(12)16)8-17-20-11;1-21-14(18-13(20-21)11-3-2-6-22-11)17-10-5-4-9-8(12(10)15)7-16-19-9;;;;;;;;;;;;;;/h3-7,12-13H,8-11,14H2,1-2H3,(H,24,27)(H,25,26,28);3-9,11H,10H2,1-2H3,(H,26,30)(H,27,33)(H,28,29,31);3-6,9-10H,7-8H2,1-2H3,(H,22,25)(H,23,24,26);3-9H,1-2H3,(H,19,22)(H,20,21,23);2-8,24H,1H3,(H,18,21)(H,19,20,22);2-4,8H,5-7H2,1H3,(H,17,20)(H,18,19,21);2-7H,1H3,(H,16,19)(H,17,18,20);14*1H |
| InChIKey | NYXRATURNMRXJJ-UHFFFAOYSA-N |
| XLogP | 28.00 |
| TPSA | 616.89 Ų |
| H-Bond Donors | 16 |
| H-Bond Acceptors | 44 |
| Rotatable Bonds | 28 |
| Heavy Atoms | 188 |
| Complexity | — |
Lipinski Rule of Five
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2708.01 |
| LogP ≤ 5 | 28.00 |
| H-Bond Donors ≤ 5 | 16 |
| H-Bond Acceptors ≤ 10 | 44 |
Frequently Asked Questions
What is the IUPAC name of 4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen?
The IUPAC name of 4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen (CID 159925195) is 4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen.
What is the SMILES notation for 4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen?
The canonical SMILES for 4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen is CC(NC(=O)COc1ccc(-c2nc(Nc3ccc4[nH]ncc4c3Cl)n(C)n2)cc1)C(F)(F)F.CN1CCN(Cc2cccc(-c3nc(Nc4ccc5[nH]ncc5c4Cl)n(C)n3)c2)CC1.CN1CCc2cc(-c3nc(Nc4ccc5[nH]ncc5c4Cl)n(C)n3)ccc2C1=O.COc1ccc(-c2nc(Nc3ccc4[nH]ncc4c3Cl)n(C)n2)cc1.Cn1nc(-c2cccc(O)c2)nc1Nc1ccc2[nH]ncc2c1Cl.Cn1nc(-c2ccco2)nc1Nc1ccc2[nH]ncc2c1Cl.Cn1nc(C2=CCOCC2)nc1Nc1ccc2[nH]ncc2c1Cl.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].
What is the InChIKey of 4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen?
The InChIKey is NYXRATURNMRXJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25ClN8.C21H19ClF3N7O2.C20H18ClN7O.C17H15ClN6O.C16H13ClN6O.C15H15ClN6O.C14H11ClN6O.14H2/c1-29-8-10-31(11-9-29)14-15-4-3-5-16(12-15)21-26-22(30(2)28-21)25-19-7-6-18-17(20(19)23)13-24-27-18;1-11(21(23,24)25)27-17(33)10-34-13-5-3-12(4-6-13)19-29-20(32(2)31-19)28-16-8-7-15-14(18(16)22)9-26-30-15;1-27-8-7-11-9-12(3-4-13(11)19(27)29)18-24-20(28(2)26-18)23-16-6-5-15-14(17(16)21)10-22-25-15;1-24-17(20-14-8-7-13-12(15(14)18)9-19-22-13)21-16(23-24)10-3-5-11(25-2)6-4-10;1-23-16(20-15(22-23)9-3-2-4-10(24)7-9)19-13-6-5-12-11(14(13)17)8-18-21-12;1-22-15(19-14(21-22)9-4-6-23-7-5-9)18-12-3-2-11-10(13(12)16)8-17-20-11;1-21-14(18-13(20-21)11-3-2-6-22-11)17-10-5-4-9-8(12(10)15)7-16-19-9;;;;;;;;;;;;;;/h3-7,12-13H,8-11,14H2,1-2H3,(H,24,27)(H,25,26,28);3-9,11H,10H2,1-2H3,(H,26,30)(H,27,33)(H,28,29,31);3-6,9-10H,7-8H2,1-2H3,(H,22,25)(H,23,24,26);3-9H,1-2H3,(H,19,22)(H,20,21,23);2-8,24H,1H3,(H,18,21)(H,19,20,22);2-4,8H,5-7H2,1H3,(H,17,20)(H,18,19,21);2-7H,1H3,(H,16,19)(H,17,18,20);14*1H.
What are the key properties of 4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen?
4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen has a molecular weight of 2708.01 g/mol, XLogP of 28.00, 28 rotatable bonds, 16 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[5-(3,6-dihydro-2H-pyran-4-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[5-(furan-2-yl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;6-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methyl-3,4-dihydroisoquinolin-1-one;3-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenol;2-[4-[5-[(4-chloro-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenoxy]-N-(1,1,1-trifluoropropan-2-yl)acetamide;4-chloro-N-[5-(4-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]-1H-indazol-5-amine;4-chloro-N-[2-methyl-5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-1,2,4-triazol-3-yl]-1H-indazol-5-amine;molecular hydrogen is sourced from PubChem (CID 159925195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 159925195 — identifiers, structure, computed properties (public domain)
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