D216-0344 Screening compound: 4-(3-{[4-(pyrazin-2-yl)piperazin-1-yl]sulfonyl}benzenesulfonyl)morpholine
Chemical Structure Depiction of ChemDiv screening compound D216-0344
4-(3-{[4-(pyrazin-2-yl)piperazin-1-yl]sulfonyl}benzenesulfonyl)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
D216-0344
Molecular Formula
C18H23N5O5S2 (C18 H23 N5 O5 S2)
Compound Name
4-(3-{[4-(pyrazin-2-yl)piperazin-1-yl]sulfonyl}benzenesulfonyl)morpholine
IUPAC name
4-(3-{[4-(pyrazin-2-yl)piperazin-1-yl]sulfonyl}benzenesulfonyl)morpholine
SMILES
O=S(c1cccc(S(N2CCOCC2)(=O)=O)c1)(N(CC1)CCN1c1nccnc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
453.54
Hydrogen Bond Acceptors Count
13.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
1.096
Distribution Coefficient, logD
1.096
Water Solubility, LogSw
-1.79
Polar Surface Area
92.858
Acid Dissociation Constant (pKa)
24.54
Base Dissociation Constant (pKb)
2.40
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
44.40
D216-0344 in Drug Discovery
Included in Screening Libraries
Autophagy-Targeted Library (4564 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
CNS MPO Library (28609 compounds)
Protein Arginine Methyltransferases Library (27925 compounds)
Purinergic Library (3321 compounds)
Targeted Diversity Library (40567 compounds)
Akt-Targeted Library (14764 compounds)
Included in 1.7M Stock Database
- Infections
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Nervous system
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Nervous system
- Cardiovascular
- Metabolic
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Skin
- Others
- GPCR
- Ion Channels
- Kinases
- Epigenetic
- Receptor's ligands
References: we are preparing a list of scientific research reports with D216-0344 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)