P113-3265 Screening compound: {2-[4-(4-fluorophenyl)piperazino]-1,3-thiazol-4-yl}(morpholino)methanone
Chemical Structure Depiction of ChemDiv screening compound P113-3265
{2-[4-(4-fluorophenyl)piperazino]-1,3-thiazol-4-yl}(morpholino)methanone
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
P113-3265
Molecular Formula
C18H21FN4O2S (C18 H21 FN4 O2 S)
Compound Name
{2-[4-(4-fluorophenyl)piperazino]-1,3-thiazol-4-yl}(morpholino)methanone
IUPAC name
4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-13-thiazole-4-carbonyl}morpholine
SMILES
O=C(c1csc(N(CC2)CCN2c(cc2)ccc2F)n1)N1CCOCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
376.45
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.714
Distribution Coefficient, logD
2.714
Water Solubility, LogSw
-2.88
Polar Surface Area
41.328
Acid Dissociation Constant (pKa)
23.18
Base Dissociation Constant (pKb)
1.88
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
44.44
P113-3265 in Drug Discovery
Included in Screening Libraries
PPI Helix Turn 3D-Mimetics Library (71298 compounds)
Protein-Protein Interaction Library (218420 compounds)
SmartTM Library (51161 compounds)
Alpha-Helix Mimetics Library (25899 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- PPI modulators
- Mimetics
- Mimetics
References: we are preparing a list of scientific research reports with P113-3265 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)