P605-0106 Screening compound: 1-{4-[5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-yl]piperazine-1-carbonyl}isoquinoline
Chemical Structure Depiction of ChemDiv screening compound P605-0106
1-{4-[5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-yl]piperazine-1-carbonyl}isoquinoline
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
P605-0106
Molecular Formula
C23H21N5OS (C23 H21 N5 OS)
Compound Name
1-{4-[5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-yl]piperazine-1-carbonyl}isoquinoline
IUPAC name
1-{4-[5-(4-methyl-13-thiazol-2-yl)pyridin-2-yl]piperazine-1-carbonyl}isoquinoline
SMILES
Cc1csc(-c(cc2)cnc2N(CC2)CCN2C(c2nccc3ccccc23)=O)n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
415.52
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.925
Distribution Coefficient, logD
3.405
Water Solubility, LogSw
-3.76
Polar Surface Area
47.835
Acid Dissociation Constant (pKa)
24.77
Base Dissociation Constant (pKb)
7.76
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
21.70
P605-0106 in Drug Discovery
Included in Screening Libraries
SmartTM Library (51161 compounds)
Epigenetics Focused Set (26518 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with P605-0106 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)