G786-1124 Screening compound: 4-(azepane-1-sulfonyl)-N-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]benzamide
Chemical Structure Depiction of ChemDiv screening compound G786-1124
4-(azepane-1-sulfonyl)-N-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]benzamide
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
G786-1124
Molecular Formula
C21H22N4O3S2 (C21 H22 N4 O3 S2)
Compound Name
4-(azepane-1-sulfonyl)-N-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]benzamide
IUPAC name
4-(azepane-1-sulfonyl)-N-[4-(pyridin-2-yl)-13-thiazol-2-yl]benzamide
SMILES
O=C(c(cc1)ccc1S(N1CCCCCC1)(=O)=O)Nc1nc(-c2ncccc2)cs1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
442.56
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.923
Distribution Coefficient, logD
3.917
Water Solubility, LogSw
-4.03
Polar Surface Area
74.194
Acid Dissociation Constant (pKa)
9.23
Base Dissociation Constant (pKb)
3.68
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
28.60
G786-1124 in Drug Discovery
Included in Screening Libraries
Allosteric Kinases Inhibitors Library (23117 compounds)
Anti-infective Library (19449 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Anti-HIV1 Library (19540 compounds)
Epigenetics Focused Set (26518 compounds)
Included in 1.7M Stock Database
- Cancer
- Female
- Congenital
- Skin
- Infections
- Immune system
- animal
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Antiviral
- Infections
- Immune system
- Kinases
- Proteases
References: we are preparing a list of scientific research reports with G786-1124 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)