3365-4626 Screening compound: 1-(3-chloro-1-benzothiophene-2-carbonyl)-4-(2-methoxyphenyl)piperazine
Chemical Structure Depiction of ChemDiv screening compound 3365-4626
1-(3-chloro-1-benzothiophene-2-carbonyl)-4-(2-methoxyphenyl)piperazine
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
3365-4626
Molecular Formula
C20H19ClN2O2S (C20 H19 ClN2 O2 S)
Compound Name
1-(3-chloro-1-benzothiophene-2-carbonyl)-4-(2-methoxyphenyl)piperazine
IUPAC name
1-(3-chloro-1-benzothiophene-2-carbonyl)-4-(2-methoxyphenyl)piperazine
SMILES
COc(cccc1)c1N(CC1)CCN1C(c(sc1c2cccc1)c2Cl)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
386.9
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
4.692
Distribution Coefficient, logD
4.692
Water Solubility, LogSw
-4.78
Polar Surface Area
28.223
Acid Dissociation Constant (pKa)
28.47
Base Dissociation Constant (pKb)
3.35
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
25.00
3365-4626 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
Nucleic Acid Ligands (8311 compounds)
Regenerative Medicine Focused Library (23016 compounds)
STING Agonist Library (5895 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Infections
- Cancer
- Musculoskeletal
- Nervous system
- Hemic and lymphatic
- Immune system
- Musculoskeletal
- Digestive system
- Hemic and lymphatic
- Cardiovascular
- Skin
- wounds
- Cancer
- Immune system
- Epigenetic
- Others
References: we are preparing a list of scientific research reports with 3365-4626 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)