E782-0765 Screening compound: 3-(4-bromophenyl)-7-(morpholinosulfonyl)-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Chemical Structure Depiction of ChemDiv screening compound E782-0765
3-(4-bromophenyl)-7-(morpholinosulfonyl)-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-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
E782-0765
Molecular Formula
C17H16BrN3O5S2 (C17 H16 BrN3 O5 S2)
Compound Name
3-(4-bromophenyl)-7-(morpholinosulfonyl)-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
IUPAC name
3-(4-bromophenyl)-7-(morpholine-4-sulfonyl)-2H-1lambda624-benzothiadiazine-11-dione
SMILES
O=S(c(cc1)cc2c1N=C(c(cc1)ccc1Br)NS2(=O)=O)(N1CCOCC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
486.37
Hydrogen Bond Acceptors Count
11.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.361
Distribution Coefficient, logD
-1.230
Water Solubility, LogSw
-2.90
Polar Surface Area
90.234
Acid Dissociation Constant (pKa)
5.79
Base Dissociation Constant (pKb)
1.85
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
23.50
E782-0765 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
Protein Arginine Methyltransferases Library (27925 compounds)
Akt-Targeted Library (14764 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune 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
- Agro
References: we are preparing a list of scientific research reports with E782-0765 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)