Bay-2666605

HCID 137465182

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Grundinformationen

CAS: 2275774-60-0
Standard-SMILES: C[C@@H]1OC(=O)NN=C1c1ccc(-c2ccc(F)cc2)c(C(F)(F)F)c1
InChIKey: JNTJTCXFIXNXDV-VIFPVBQESA-N
Summenformel: C17H12F4N2O2
Durchschnittliche Molmasse: 352,28 g/mol
Monoisotopische Masse: 352,08349028

Überblick

SLFN12-PDE3A Complex Inducer BAY 2666605 is an orally bioavailable agent that triggers the formation of a complex of the two proteins Schlafen family member 12 (SLFN12) and phosphodiesterase 3A (PDE3A), with potential antineoplastic activity. Upon oral administration, SLFN12-PDE3A complex inducer BAY2666605 triggers the formation of the SLFN12-PDE3A complex. This stabilizes SLFN12 and alters the expression of a set of genes that regulate cell survival, death, and proliferation. This suppresses cell cycle progression and induces apoptosis in cancer cells that specifically express elevated levels of both of these proteins.

Namen und Bezeichner

Bevorzugter Name: Bay-2666605
IUPAC: (6S)-5-[4-(4-fluorophenyl)-3-(trifluoromethyl)phenyl]-6-methyl-3,6-dihydro-1,3,4-oxadiazin-2-one
Englischer Name: BAY 2666605
Summenformel: C17H12F4N2O2
Molmasse: 352.28

Namen und Synonyme

BAY-2666605BAY26666052H-1,3,4-Oxadiazin-2-one, 5-(4'-fluoro-2-(trifluoromethyl)(1,1'-biphenyl)-4-yl)-3,6-dihydro-6-methyl-, (6S)-RefChem:199713Schlafen12 Complex Inducer BAY 2666605SLFN12-PDE3A Complex Inducer BAY 2666605SLFN12/PDE3A Complex Inducer BAY 2666605BAY 26666052275774-60-0XC4ZA6OSY6UNII-XC4ZA6OSY6(6S)-5-[4-(4-fluorophenyl)-3-(trifluoromethyl)phenyl]-6-methyl-3,6-dihydro-1,3,4-oxadiazin-2-one

Weitere Namen anzeigen

BAY 266605BAY 2666605 ，E1205BAY 2666605, 10 mM in DMSO(S)-5-[4’-Fluoro-2-(trifluoromethyl)-4-biphenylyl]-6-methyl-3,6-dihydro-2H-1,3,4-oxadiazin-2-one2H-1,3,4-Oxadiazin-2-one, 5-[4'-fluoro-2-(trifluoromethyl)[1,1'-biphenyl]-4-yl]-3,6-dihydro-6-methyl-, (6S)-anticancer effect,inhibit,BAY 2666605,orally active,PDE3A-SLFN12 Complex,Phosphodiesterase (PDE),BAY2666605,BAY-2666605,Inhibitor

(S)-5-(4'-Fluoro-2-(trifluoromethyl)-[1,1'-biphenyl]-4-yl)-6-methyl-3,6-dihydro-2H-1,3,4-oxadiazin-2-oneorb1297869CHEMBL5268644SCHEMBL20705325JNTJTCXFIXNXDV-VIFPVBQESA-NBDBM568674EX-A6040NSC841296

Datenbank-Bezeichner

CAS: 2275774-60-0
PubChem CID: 137465182
ChEMBL: CHEMBL5268644
UNII: XC4ZA6OSY6

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 4,5
Polarare Oberfläche (TPSA): 50,7 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 7
Frei drehbare Bindungen: 2
Schwere Atome: 25
Formalladung: 0
Komplexität: 529

Physikochemische Eigenschaften

Dichte: 1.4 · 1.40±0.1 g/cm3(Predicted)
storage temp.: -20 °C · Store at -20°C
Aggregatzustand: Solid
pka: 9.07 · 9.07±0.60(Predicted)
Farbe: White to off-white
InChI: InChI=1S/C17H12F4N2O2/c1-9-15(22-23-16(24)25-9)11-4-7-13(14(8-11)17(19,20)21)10-2-5-12(18)6-3-10/h2-9H,1H3,(H,23,24)/t9-/m0/s1
InChIKey: JNTJTCXFIXNXDV-VIFPVBQESA-N
SMILES: O1[C@@H](C)C(C2=CC=C(C3=CC=C(F)C=C3)C(C(F)(F)F)=C2)=NNC1=O

Chemie und Industrie

Anwendungen

VerwendenBAY 2666605 is an orally active PDE3A and PDE3B inhibitor with IC50s of 87 nM and 50 nM, respectively. BAY 2666605 is a PDE3A-SLFN12 complex inducer.

Anbieter35 Anbieter

武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]

咸宁深蓝生物医药研发有限公司18171815831 · [email protected]

常州博瑞生物科技有限公司13656121842 · [email protected]

湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]

Aladdin Scientific[email protected]

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