T368-2968 Screening compound: ethyl 2-({3-[2-(thiophen-2-yl)-3H-imidazo[4,5-b]pyridin-3-yl]pyrrolidine-1-carbonyl}amino)acetate
Chemical Structure Depiction of ChemDiv screening compound T368-2968
ethyl 2-({3-[2-(thiophen-2-yl)-3H-imidazo[4,5-b]pyridin-3-yl]pyrrolidine-1-carbonyl}amino)acetate
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
T368-2968
Molecular Formula
C19H21N5O3S (C19 H21 N5 O3 S)
Compound Name
ethyl 2-({3-[2-(thiophen-2-yl)-3H-imidazo[4,5-b]pyridin-3-yl]pyrrolidine-1-carbonyl}amino)acetate
IUPAC name
ethyl 2-({3-[2-(thiophen-2-yl)-3H-imidazo[45-b]pyridin-3-yl]pyrrolidine-1-carbonyl}amino)acetate
SMILES
CCOC(CNC(N(CC1)CC1n1c(nccc2)c2nc1-c1cccs1)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
399.47
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.223
Distribution Coefficient, logD
2.223
Water Solubility, LogSw
-2.45
Polar Surface Area
68.726
Acid Dissociation Constant (pKa)
14.93
Base Dissociation Constant (pKb)
2.41
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
36.80
T368-2968 in Drug Discovery
Included in Screening Libraries
Angiogenesis library (14822 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- Cancer
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with T368-2968 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)