E643-0170 Screening compound: N-[4-(dimethylamino)phenyl]-2-(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)acetamide
Chemical Structure Depiction of ChemDiv screening compound E643-0170
N-[4-(dimethylamino)phenyl]-2-(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)acetamide
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
E643-0170
Molecular Formula
C23H22FN5OS (C23 H22 FN5 OS)
Compound Name
N-[4-(dimethylamino)phenyl]-2-(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)acetamide
IUPAC name
N-[4-(dimethylamino)phenyl]-2-(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[45-b]pyridin-3-yl)acetamide
SMILES
CN(C)c(cc1)ccc1NC(Cn1c(SCc(cc2)ccc2F)nc2c1nccc2)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
435.53
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.235
Distribution Coefficient, logD
4.226
Water Solubility, LogSw
-4.16
Polar Surface Area
46.338
Acid Dissociation Constant (pKa)
12.27
Base Dissociation Constant (pKb)
9.04
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
17.40
E643-0170 in Drug Discovery
Included in Screening Libraries
Angiogenesis library (14822 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Epigenetics Focused Set (26518 compounds)
Included in 1.7M Stock Database
- Cancer
References: we are preparing a list of scientific research reports with E643-0170 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)