D009-0006 Screening compound: (2Z)-3-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-N-[(furan-2-yl)methyl]-2-(phenylformamido)prop-2-enamide
Chemical Structure Depiction of ChemDiv screening compound D009-0006
(2Z)-3-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-N-[(furan-2-yl)methyl]-2-(phenylformamido)prop-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
D009-0006
Molecular Formula
C25H24N4O5S (C25 H24 N4 O5 S)
Compound Name
(2Z)-3-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-N-[(furan-2-yl)methyl]-2-(phenylformamido)prop-2-enamide
IUPAC name
(2Z)-3-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-N-[(furan-2-yl)methyl]-2-(phenylformamido)prop-2-enamide
SMILES
CN(C)S(n1c(cccc2)c2c(/C=C(/C(NCc2ccco2)=O)\NC(c2ccccc2)=O)c1)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
492.56
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
3.061
Distribution Coefficient, logD
1.919
Water Solubility, LogSw
-3.41
Polar Surface Area
87.677
Acid Dissociation Constant (pKa)
6.29
Base Dissociation Constant (pKb)
-1.38
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
12.00
D009-0006 in Drug Discovery
Included in Screening Libraries
Lipid Metabolism Library (9174 compounds)
?ysteine Targeted Covalent Library (39471 compounds)
Included in 1.7M Stock Database
- Cardiovascular
- Metabolic
References: we are preparing a list of scientific research reports with D009-0006 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)