G786-2340 Screening compound: (2Z)-N-[3-(1,3-benzothiazol-2-yl)-6-ethyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl]-3-phenylprop-2-enamide
Chemical Structure Depiction of ChemDiv screening compound G786-2340
(2Z)-N-[3-(1,3-benzothiazol-2-yl)-6-ethyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl]-3-phenylprop-2-enamide
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
G786-2340
Molecular Formula
C25H23N3OS2 (C25 H23 N3 OS2)
Compound Name
(2Z)-N-[3-(1,3-benzothiazol-2-yl)-6-ethyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl]-3-phenylprop-2-enamide
IUPAC name
(2Z)-N-[3-(13-benzothiazol-2-yl)-6-ethyl-4H5H6H7H-thieno[23-c]pyridin-2-yl]-3-phenylprop-2-enamide
SMILES
CCN(CC1)Cc2c1c(-c1nc(cccc3)c3s1)c(NC(/C=C\c1ccccc1)=O)s2
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
445.61
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
6.019
Distribution Coefficient, logD
5.792
Water Solubility, LogSw
-5.58
Polar Surface Area
35.750
Acid Dissociation Constant (pKa)
9.18
Base Dissociation Constant (pKb)
7.22
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
20.00
G786-2340 in Drug Discovery
Included in Screening Libraries
Eccentric PPI Library (11937 compounds)
MCL1 Targeted Library (12200 compounds)
Protein-Protein Interaction Library (218420 compounds)
Covalent Inhibitors Library (7986 compounds)
?ysteine Targeted Covalent Library (39471 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- Cyclic compounds
- Cyclic compounds
- 3D
- Fragments
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
References: we are preparing a list of scientific research reports with G786-2340 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)