P657-0526 Screening compound: 4-({5-[5-(propan-2-yl)-1,3,4-oxadiazol-2-yl]furan-2-yl}sulfonyl)morpholine
Chemical Structure Depiction of ChemDiv screening compound P657-0526
4-({5-[5-(propan-2-yl)-1,3,4-oxadiazol-2-yl]furan-2-yl}sulfonyl)morpholine
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
P657-0526
Molecular Formula
C13H17N3O5S (C13 H17 N3 O5 S)
Compound Name
4-({5-[5-(propan-2-yl)-1,3,4-oxadiazol-2-yl]furan-2-yl}sulfonyl)morpholine
IUPAC name
4-({5-[5-(propan-2-yl)-134-oxadiazol-2-yl]furan-2-yl}sulfonyl)morpholine
SMILES
CC(C)c1nnc(-c(o2)ccc2S(N2CCOCC2)(=O)=O)o1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
327.36
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
1.494
Distribution Coefficient, logD
1.494
Water Solubility, LogSw
-2.16
Polar Surface Area
79.265
Acid Dissociation Constant (pKa)
26.04
Base Dissociation Constant (pKb)
-1.75
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
53.80
P657-0526 in Drug Discovery
Included in Screening Libraries
CNS MPO Library (28609 compounds)
Protein Arginine Methyltransferases Library (27925 compounds)
SmartTM Library (51161 compounds)
Targeted Diversity Library (40567 compounds)
Akt-Targeted Library (14764 compounds)
Included in 1.7M Stock Database
- Nervous system
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Skin
- Others
- Kinases
- Epigenetic
References: we are preparing a list of scientific research reports with P657-0526 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)