F406-0988 Screening compound: 7-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-3-[(4-fluorophenyl)methyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione
Chemical Structure Depiction of ChemDiv screening compound F406-0988
7-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-3-[(4-fluorophenyl)methyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
F406-0988
Molecular Formula
C23H14BrFN4O3 (C23 H14 BrFN4 O3)
Compound Name
7-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-3-[(4-fluorophenyl)methyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione
IUPAC name
7-[3-(3-bromophenyl)-124-oxadiazol-5-yl]-3-[(4-fluorophenyl)methyl]-1234-tetrahydroquinazoline-24-dione
SMILES
O=C(c(ccc(-c1nc(-c2cccc(Br)c2)no1)c1)c1N1)N(Cc(cc2)ccc2F)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
493.29
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
5.982
Distribution Coefficient, logD
5.982
Water Solubility, LogSw
-6.01
Polar Surface Area
71.886
Acid Dissociation Constant (pKa)
11.19
Base Dissociation Constant (pKb)
-6.26
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
4.30
F406-0988 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Protein-Protein Interaction Library (218420 compounds)
Adenosine Receptors Targeted Library (19896 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- PPI modulators
- Receptor's ligands
- GPCR
References: we are preparing a list of scientific research reports with F406-0988 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)