E734-2625 Screening compound: 4-({5,7-dioxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-6-yl}methyl)-N-(pyridin-3-yl)benzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound E734-2625
4-({5,7-dioxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-6-yl}methyl)-N-(pyridin-3-yl)benzene-1-sulfonamide
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
E734-2625
Molecular Formula
C19H14N4O4S (C19 H14 N4 O4 S)
Compound Name
4-({5,7-dioxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-6-yl}methyl)-N-(pyridin-3-yl)benzene-1-sulfonamide
IUPAC name
4-({57-dioxo-5H6H7H-pyrrolo[34-b]pyridin-6-yl}methyl)-N-(pyridin-3-yl)benzene-1-sulfonamide
SMILES
O=C(c1c2nccc1)N(Cc(cc1)ccc1S(Nc1cnccc1)(=O)=O)C2=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
394.41
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
0.893
Distribution Coefficient, logD
0.833
Water Solubility, LogSw
-2.39
Polar Surface Area
89.568
Acid Dissociation Constant (pKa)
8.40
Base Dissociation Constant (pKb)
6.04
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
5.30
E734-2625 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Cysteine Proteases Inhibitors Library (7839 compounds)
PI3K-Targeted Library (17255 compounds)
Neuropeptide S Library (2850 compounds)
Included in 1.7M Stock Database
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Nervous system
- Cardiovascular
- Skin
- Metabolic
- Endocrine
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Digestive system
- Nervous system
- Proteases
- Kinases
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with E734-2625 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)