P605-0246 Screening compound: 1-(2,3-dimethoxybenzoyl)-4-[5-(4-ethyl-1,3-thiazol-2-yl)pyridin-2-yl]piperazine
Chemical Structure Depiction of ChemDiv screening compound P605-0246
1-(2,3-dimethoxybenzoyl)-4-[5-(4-ethyl-1,3-thiazol-2-yl)pyridin-2-yl]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
P605-0246
Molecular Formula
C23H26N4O3S (C23 H26 N4 O3 S)
Compound Name
1-(2,3-dimethoxybenzoyl)-4-[5-(4-ethyl-1,3-thiazol-2-yl)pyridin-2-yl]piperazine
IUPAC name
1-(23-dimethoxybenzoyl)-4-[5-(4-ethyl-13-thiazol-2-yl)pyridin-2-yl]piperazine
SMILES
CCc1csc(-c(cc2)cnc2N(CC2)CCN2C(c(cccc2OC)c2OC)=O)n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
438.55
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
4.268
Distribution Coefficient, logD
3.748
Water Solubility, LogSw
-4.19
Polar Surface Area
54.325
Acid Dissociation Constant (pKa)
24.69
Base Dissociation Constant (pKb)
7.76
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
34.80
P605-0246 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Epigenetics Focused Set (26518 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with P605-0246 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)