P193-0709 Screening compound: 1-(4-phenylpiperazin-1-yl)-2-{2-[2-(thiomorpholin-4-yl)pyridin-4-yl]-1H-imidazol-1-yl}ethan-1-one
Chemical Structure Depiction of ChemDiv screening compound P193-0709
1-(4-phenylpiperazin-1-yl)-2-{2-[2-(thiomorpholin-4-yl)pyridin-4-yl]-1H-imidazol-1-yl}ethan-1-one
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
P193-0709
Molecular Formula
C24H28N6OS (C24 H28 N6 OS)
Compound Name
1-(4-phenylpiperazin-1-yl)-2-{2-[2-(thiomorpholin-4-yl)pyridin-4-yl]-1H-imidazol-1-yl}ethan-1-one
IUPAC name
1-(4-phenylpiperazin-1-yl)-2-{2-[2-(thiomorpholin-4-yl)pyridin-4-yl]-1H-imidazol-1-yl}ethan-1-one
SMILES
O=C(Cn1c(-c2cc(N3CCSCC3)ncc2)ncc1)N(CC1)CCN1c1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
448.59
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.951
Distribution Coefficient, logD
2.921
Water Solubility, LogSw
-3.28
Polar Surface Area
43.093
Acid Dissociation Constant (pKa)
17.72
Base Dissociation Constant (pKb)
6.25
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
37.50
P193-0709 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
GPCR Targeted Library (31838 compounds)
SmartTM Library (51161 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with P193-0709 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)