5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole
C169H145F6N22O8S7- — CID 159734251
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAC5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole
SMILESCc1cc(-c2ncc(-n3cccn3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3ccc(CN4CCOCC4)cc3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3ccc(NS(=O)[O-])cc3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3ccc(OC4CCOCC4)cc3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3ccc(OCCO)c(C)c3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3cccc(N4CCOCC4)c3)cc2-c2ccc3ncsc3c2)ccc1F
InChIInChI=1S/C31H29FN4OS.C31H28FN3O2S.C30H27FN4OS.C29H26FN3O2S.C26H21FN4O2S2.C22H15FN4S/c1-21-14-25(6-8-28(21)32)31-27(24-7-9-29-30(15-24)38-20-35-29)16-26(18-34-31)33-17-22-2-4-23(5-3-22)19-36-10-12-37-13-11-36;1-20-14-23(4-8-28(20)32)31-27(22-5-9-29-30(15-22)38-19-35-29)16-24(18-34-31)33-17-21-2-6-25(7-3-21)37-26-10-12-36-13-11-26;1-20-13-23(5-7-27(20)31)30-26(22-6-8-28-29(15-22)37-19-34-28)16-24(18-33-30)32-17-21-3-2-4-25(14-21)35-9-11-36-12-10-35;1-18-12-22(4-6-25(18)30)29-24(21-5-7-26-28(13-21)36-17-33-26)14-23(16-32-29)31-15-20-3-8-27(19(2)11-20)35-10-9-34;1-16-10-19(4-8-23(16)27)26-22(18-5-9-24-25(11-18)34-15-30-24)12-21(14-29-26)28-13-17-2-6-20(7-3-17)31-35(32)33;1-14-9-16(3-5-19(14)23)22-18(11-17(12-24-22)27-8-2-7-26-27)15-4-6-20-21(10-15)28-13-25-20/h2-9,14-16,18,20,33H,10-13,17,19H2,1H3;2-9,14-16,18-19,26,33H,10-13,17H2,1H3;2-8,13-16,18-19,32H,9-12,17H2,1H3;3-8,11-14,16-17,31,34H,9-10,15H2,1-2H3;2-12,14-15,28,31H,13H2,1H3,(H,32,33);2-13H,1H3/p-1
InChIKeyQRRRYQDKMYQSRK-UHFFFAOYSA-M
MW2950.62 g/mol
LogP40.20
Rot. Bonds38
About 5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole
5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole (PubChem CID 159734251) has the molecular formula C169H145F6N22O8S7- and a molecular weight of 2950.62 g/mol. Its IUPAC name is 5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole.
Molecular Properties
| Compound Name | 5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole |
|---|---|
| PubChem CID | 159734251 |
| Molecular Formula | C169H145F6N22O8S7- |
| Molecular Weight | 2950.62 g/mol |
| Exact Mass | 2947.96 |
| IUPAC Name | 5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole |
| SMILES | Cc1cc(-c2ncc(-n3cccn3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3ccc(CN4CCOCC4)cc3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3ccc(NS(=O)[O-])cc3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3ccc(OC4CCOCC4)cc3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3ccc(OCCO)c(C)c3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3cccc(N4CCOCC4)c3)cc2-c2ccc3ncsc3c2)ccc1F |
| InChI | InChI=1S/C31H29FN4OS.C31H28FN3O2S.C30H27FN4OS.C29H26FN3O2S.C26H21FN4O2S2.C22H15FN4S/c1-21-14-25(6-8-28(21)32)31-27(24-7-9-29-30(15-24)38-20-35-29)16-26(18-34-31)33-17-22-2-4-23(5-3-22)19-36-10-12-37-13-11-36;1-20-14-23(4-8-28(20)32)31-27(22-5-9-29-30(15-22)38-19-35-29)16-24(18-34-31)33-17-21-2-6-25(7-3-21)37-26-10-12-36-13-11-26;1-20-13-23(5-7-27(20)31)30-26(22-6-8-28-29(15-22)37-19-34-28)16-24(18-33-30)32-17-21-3-2-4-25(14-21)35-9-11-36-12-10-35;1-18-12-22(4-6-25(18)30)29-24(21-5-7-26-28(13-21)36-17-33-26)14-23(16-32-29)31-15-20-3-8-27(19(2)11-20)35-10-9-34;1-16-10-19(4-8-23(16)27)26-22(18-5-9-24-25(11-18)34-15-30-24)12-21(14-29-26)28-13-17-2-6-20(7-3-17)31-35(32)33;1-14-9-16(3-5-19(14)23)22-18(11-17(12-24-22)27-8-2-7-26-27)15-4-6-20-21(10-15)28-13-25-20/h2-9,14-16,18,20,33H,10-13,17,19H2,1H3;2-9,14-16,18-19,26,33H,10-13,17H2,1H3;2-8,13-16,18-19,32H,9-12,17H2,1H3;3-8,11-14,16-17,31,34H,9-10,15H2,1-2H3;2-12,14-15,28,31H,13H2,1H3,(H,32,33);2-13H,1H3/p-1 |
| InChIKey | QRRRYQDKMYQSRK-UHFFFAOYSA-M |
| XLogP | 40.20 |
| TPSA | 357.67 Ų |
| H-Bond Donors | 7 |
| H-Bond Acceptors | 35 |
| Rotatable Bonds | 38 |
| Heavy Atoms | 212 |
| Complexity | — |
Lipinski Rule of Five
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2950.62 |
| LogP ≤ 5 | 40.20 |
| H-Bond Donors ≤ 5 | 7 |
| H-Bond Acceptors ≤ 10 | 35 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'sulfinic_acid', 'substructure': 'N/A'} |
|---|
Frequently Asked Questions
What is the IUPAC name of 5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole?
The IUPAC name of 5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole (CID 159734251) is 5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole.
What is the SMILES notation for 5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole?
The canonical SMILES for 5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole is Cc1cc(-c2ncc(-n3cccn3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3ccc(CN4CCOCC4)cc3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3ccc(NS(=O)[O-])cc3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3ccc(OC4CCOCC4)cc3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3ccc(OCCO)c(C)c3)cc2-c2ccc3ncsc3c2)ccc1F.Cc1cc(-c2ncc(NCc3cccc(N4CCOCC4)c3)cc2-c2ccc3ncsc3c2)ccc1F.
What is the InChIKey of 5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole?
The InChIKey is QRRRYQDKMYQSRK-UHFFFAOYSA-M. The full InChI is InChI=1S/C31H29FN4OS.C31H28FN3O2S.C30H27FN4OS.C29H26FN3O2S.C26H21FN4O2S2.C22H15FN4S/c1-21-14-25(6-8-28(21)32)31-27(24-7-9-29-30(15-24)38-20-35-29)16-26(18-34-31)33-17-22-2-4-23(5-3-22)19-36-10-12-37-13-11-36;1-20-14-23(4-8-28(20)32)31-27(22-5-9-29-30(15-22)38-19-35-29)16-24(18-34-31)33-17-21-2-6-25(7-3-21)37-26-10-12-36-13-11-26;1-20-13-23(5-7-27(20)31)30-26(22-6-8-28-29(15-22)37-19-34-28)16-24(18-33-30)32-17-21-3-2-4-25(14-21)35-9-11-36-12-10-35;1-18-12-22(4-6-25(18)30)29-24(21-5-7-26-28(13-21)36-17-33-26)14-23(16-32-29)31-15-20-3-8-27(19(2)11-20)35-10-9-34;1-16-10-19(4-8-23(16)27)26-22(18-5-9-24-25(11-18)34-15-30-24)12-21(14-29-26)28-13-17-2-6-20(7-3-17)31-35(32)33;1-14-9-16(3-5-19(14)23)22-18(11-17(12-24-22)27-8-2-7-26-27)15-4-6-20-21(10-15)28-13-25-20/h2-9,14-16,18,20,33H,10-13,17,19H2,1H3;2-9,14-16,18-19,26,33H,10-13,17H2,1H3;2-8,13-16,18-19,32H,9-12,17H2,1H3;3-8,11-14,16-17,31,34H,9-10,15H2,1-2H3;2-12,14-15,28,31H,13H2,1H3,(H,32,33);2-13H,1H3/p-1.
What are the key properties of 5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole?
5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole has a molecular weight of 2950.62 g/mol, XLogP of 40.20, 38 rotatable bonds, 7 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[(3-morpholin-4-ylphenyl)methyl]pyridin-3-amine;5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-N-[[4-(oxan-4-yloxy)phenyl]methyl]pyridin-3-amine;2-[4-[[[5-(1,3-benzothiazol-6-yl)-6-(4-fluoro-3-methylphenyl)-3-pyridinyl]amino]methyl]-2-methylphenoxy]ethanol;6-[2-(4-fluoro-3-methylphenyl)-5-pyrazol-1-yl-3-pyridinyl]-1,3-benzothiazole;6-[2-(4-fluoro-3-methylphenyl)-5-[[4-(sulfinatoamino)phenyl]methylamino]-3-pyridinyl]-1,3-benzothiazole is sourced from PubChem (CID 159734251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 159734251 — identifiers, structure, computed properties (public domain)
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