G784-0678 Screening compound: (4-chlorophenyl)methyl 3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
Chemical Structure Depiction of ChemDiv screening compound G784-0678
(4-chlorophenyl)methyl 3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
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
G784-0678
Molecular Formula
C20H14Cl2N2O2S (C20 H14 Cl2 N2 O2 S)
Compound Name
(4-chlorophenyl)methyl 3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
IUPAC name
(4-chlorophenyl)methyl 3-(4-chlorophenyl)-1-methyl-1H-thieno[23-c]pyrazole-5-carboxylate
SMILES
Cn(c1c2cc(C(OCc(cc3)ccc3Cl)=O)s1)nc2-c(cc1)ccc1Cl
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
417.31
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
5.851
Distribution Coefficient, logD
5.851
Water Solubility, LogSw
-6.15
Polar Surface Area
36.214
Acid Dissociation Constant (pKa)
30.33
Base Dissociation Constant (pKb)
-1.88
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
10.00
G784-0678 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
References: we are preparing a list of scientific research reports with G784-0678 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)