5H7
N-{4-[(1R,3S,5S)-3-amino-5-methylcyclohexyl]pyridin-3-yl}-6-(2,6-difluorophenyl)-5-fluoropyridine-2-carboxamide
Find entries where: 5H7
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | N-{4-[(1R,3S,5S)-3-amino-5-methylcyclohexyl]pyridin-3-yl}-6-(2,6-difluorophenyl)-5-fluoropyridine-2-carboxamide |
Identifiers | N-[4-[(1R,3S,5S)-3-azanyl-5-methyl-cyclohexyl]pyridin-3-yl]-6-[2,6-bis(fluoranyl)phenyl]-5-fluoranyl-pyridine-2-carboxamide |
Formula | C24 H23 F3 N4 O |
Molecular Weight | 440.461 |
Type | NON-POLYMER |
Isomeric SMILES | C[C@H]1C[C@H](C[C@H](C1)N)c2ccncc2NC(=O)c3ccc(c(n3)c4c(cccc4F)F)F |
InChI | InChI=1S/C24H23F3N4O/c1-13-9-14(11-15(28)10-13)16-7-8-29-12-21(16)31-24(32)20-6-5-19(27)23(30-20)22-17(25)3-2-4-18(22)26/h2-8,12-15H,9-11,28H2,1H3,(H,31,32)/t13-,14+,15-/m0/s1 |
InChIKey | VRQXRVAKPDCRCI-ZNMIVQPWSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 55 |
Chiral Atom Count | 3 |
Bond Count | 58 |
Aromatic Bond Count | 18 |
Drug Info: DrugBank
DrugBank ID | DB14943 |
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Name | LGH-447 |
Groups | investigational |
Description | LGH-447 is under investigation in clinical trial NCT02160951 (Dose Escalation Study of LGH447 in Japanese Patients With Relapsed and/or Refractory Hematologic Malignancies). |
Synonyms | LGH-447 |
CAS number | 1210608-43-7 |
Related Resource References
Resource Name | Reference |
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Pharos | CHEMBL3651966 |
PubChem | 44814409 |
ChEMBL | CHEMBL3651966 |