[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride
C127H144Cl13F6N31O9 — CID 159958806
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAC[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride
SMILESCc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(C3=CC(C)N(C(=O)C4CCCN4)CC3)cnc12.Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(C3=CCN(C(=O)C4CCCCN4)CC3)cnc12.Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(C3=CCN(C(=O)C4CCCN4)C(C)C3)cnc12.Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(C3=CCN(C(=O)C4CCCN4)CC3)cnc12.Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(N3CCN(C(=O)C4CCCN4)C(C)C3)cnc12.Cl.Cl.Cl.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F
InChIInChI=1S/3C25H28Cl2N6O.C24H29Cl2N7O.C24H26Cl2N6O.2C2HF3O2.3ClH/c2*1-14-11-17(8-10-32(14)25(34)21-5-4-9-28-21)22-13-29-23-15(2)31-33(24(23)30-22)16(3)19-7-6-18(26)12-20(19)27;1-15-23-24(33(31-15)16(2)19-7-6-18(26)13-20(19)27)30-22(14-29-23)17-8-11-32(12-9-17)25(34)21-5-3-4-10-28-21;1-14-13-31(9-10-32(14)24(34)20-5-4-8-27-20)21-12-28-22-15(2)30-33(23(22)29-21)16(3)18-7-6-17(25)11-19(18)26;1-14-22-23(32(30-14)15(2)18-6-5-17(25)12-19(18)26)29-21(13-28-22)16-7-10-31(11-8-16)24(33)20-4-3-9-27-20;2*3-2(4,5)1(6)7;;;/h6-7,11-14,16,21,28H,4-5,8-10H2,1-3H3;6-8,12-14,16,21,28H,4-5,9-11H2,1-3H3;6-8,13-14,16,21,28H,3-5,9-12H2,1-2H3;6-7,11-12,14,16,20,27H,4-5,8-10,13H2,1-3H3;5-7,12-13,15,20,27H,3-4,8-11H2,1-2H3;2*(H,6,7);3*1H
InChIKeyIQZGULCVAZDGIO-UHFFFAOYSA-N
MW2823.63 g/mol
LogP25.21
Rot. Bonds20
About [4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride
[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride (PubChem CID 159958806) has the molecular formula C127H144Cl13F6N31O9 and a molecular weight of 2823.63 g/mol. Its IUPAC name is [4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride.
Molecular Properties
| Compound Name | [4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride |
|---|---|
| PubChem CID | 159958806 |
| Molecular Formula | C127H144Cl13F6N31O9 |
| Molecular Weight | 2823.63 g/mol |
| Exact Mass | 2815.76 |
| IUPAC Name | [4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride |
| SMILES | Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(C3=CC(C)N(C(=O)C4CCCN4)CC3)cnc12.Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(C3=CCN(C(=O)C4CCCCN4)CC3)cnc12.Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(C3=CCN(C(=O)C4CCCN4)C(C)C3)cnc12.Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(C3=CCN(C(=O)C4CCCN4)CC3)cnc12.Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(N3CCN(C(=O)C4CCCN4)C(C)C3)cnc12.Cl.Cl.Cl.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F |
| InChI | InChI=1S/3C25H28Cl2N6O.C24H29Cl2N7O.C24H26Cl2N6O.2C2HF3O2.3ClH/c2*1-14-11-17(8-10-32(14)25(34)21-5-4-9-28-21)22-13-29-23-15(2)31-33(24(23)30-22)16(3)19-7-6-18(26)12-20(19)27;1-15-23-24(33(31-15)16(2)19-7-6-18(26)13-20(19)27)30-22(14-29-23)17-8-11-32(12-9-17)25(34)21-5-3-4-10-28-21;1-14-13-31(9-10-32(14)24(34)20-5-4-8-27-20)21-12-28-22-15(2)30-33(23(22)29-21)16(3)18-7-6-17(25)11-19(18)26;1-14-22-23(32(30-14)15(2)18-6-5-17(25)12-19(18)26)29-21(13-28-22)16-7-10-31(11-8-16)24(33)20-4-3-9-27-20;2*3-2(4,5)1(6)7;;;/h6-7,11-14,16,21,28H,4-5,8-10H2,1-3H3;6-8,12-14,16,21,28H,4-5,9-11H2,1-3H3;6-8,13-14,16,21,28H,3-5,9-12H2,1-2H3;6-7,11-12,14,16,20,27H,4-5,8-10,13H2,1-3H3;5-7,12-13,15,20,27H,3-4,8-11H2,1-2H3;2*(H,6,7);3*1H |
| InChIKey | IQZGULCVAZDGIO-UHFFFAOYSA-N |
| XLogP | 25.21 |
| TPSA | 457.54 Ų |
| H-Bond Donors | 7 |
| H-Bond Acceptors | 33 |
| Rotatable Bonds | 20 |
| Heavy Atoms | 186 |
| Complexity | — |
Lipinski Rule of Five
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2823.63 |
| LogP ≤ 5 | 25.21 |
| H-Bond Donors ≤ 5 | 7 |
| H-Bond Acceptors ≤ 10 | 33 |
Frequently Asked Questions
What is the IUPAC name of [4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride?
The IUPAC name of [4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride (CID 159958806) is [4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride.
What is the SMILES notation for [4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride?
The canonical SMILES for [4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride is Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(C3=CC(C)N(C(=O)C4CCCN4)CC3)cnc12.Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(C3=CCN(C(=O)C4CCCCN4)CC3)cnc12.Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(C3=CCN(C(=O)C4CCCN4)C(C)C3)cnc12.Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(C3=CCN(C(=O)C4CCCN4)CC3)cnc12.Cc1nn(C(C)c2ccc(Cl)cc2Cl)c2nc(N3CCN(C(=O)C4CCCN4)C(C)C3)cnc12.Cl.Cl.Cl.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.
What is the InChIKey of [4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride?
The InChIKey is IQZGULCVAZDGIO-UHFFFAOYSA-N. The full InChI is InChI=1S/3C25H28Cl2N6O.C24H29Cl2N7O.C24H26Cl2N6O.2C2HF3O2.3ClH/c2*1-14-11-17(8-10-32(14)25(34)21-5-4-9-28-21)22-13-29-23-15(2)31-33(24(23)30-22)16(3)19-7-6-18(26)12-20(19)27;1-15-23-24(33(31-15)16(2)19-7-6-18(26)13-20(19)27)30-22(14-29-23)17-8-11-32(12-9-17)25(34)21-5-3-4-10-28-21;1-14-13-31(9-10-32(14)24(34)20-5-4-8-27-20)21-12-28-22-15(2)30-33(23(22)29-21)16(3)18-7-6-17(25)11-19(18)26;1-14-22-23(32(30-14)15(2)18-6-5-17(25)12-19(18)26)29-21(13-28-22)16-7-10-31(11-8-16)24(33)20-4-3-9-27-20;2*3-2(4,5)1(6)7;;;/h6-7,11-14,16,21,28H,4-5,8-10H2,1-3H3;6-8,12-14,16,21,28H,4-5,9-11H2,1-3H3;6-8,13-14,16,21,28H,3-5,9-12H2,1-2H3;6-7,11-12,14,16,20,27H,4-5,8-10,13H2,1-3H3;5-7,12-13,15,20,27H,3-4,8-11H2,1-2H3;2*(H,6,7);3*1H.
What are the key properties of [4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride?
[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride has a molecular weight of 2823.63 g/mol, XLogP of 25.21, 20 rotatable bonds, 7 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;bis(2,2,2-trifluoroacetic acid);trihydrochloride is sourced from PubChem (CID 159958806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 159958806 — identifiers, structure, computed properties (public domain)
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