P578-2004 Screening compound: 4-{6-[4-(4-propylpiperazine-1-carbonyl)-1H-imidazol-1-yl]pyrimidin-4-yl}thiomorpholine
Chemical Structure Depiction of ChemDiv screening compound P578-2004
4-{6-[4-(4-propylpiperazine-1-carbonyl)-1H-imidazol-1-yl]pyrimidin-4-yl}thiomorpholine
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
P578-2004
Molecular Formula
C19H27N7OS (C19 H27 N7 OS)
Compound Name
4-{6-[4-(4-propylpiperazine-1-carbonyl)-1H-imidazol-1-yl]pyrimidin-4-yl}thiomorpholine
IUPAC name
4-{6-[4-(4-propylpiperazine-1-carbonyl)-1H-imidazol-1-yl]pyrimidin-4-yl}thiomorpholine
SMILES
CCCN(CC1)CCN1C(c(nc1)cn1-c1cc(N2CCSCC2)ncn1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
401.54
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.368
Distribution Coefficient, logD
2.183
Water Solubility, LogSw
-2.34
Polar Surface Area
55.105
Acid Dissociation Constant (pKa)
23.11
Base Dissociation Constant (pKb)
7.12
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
57.90
P578-2004 in Drug Discovery
Included in Screening Libraries
SmartTM Library (51161 compounds)
Ion Channels Focused Library (26372 compounds)
Included in 1.7M Stock Database
- Nervous system
- Cardiovascular
- Ion Channels
References: we are preparing a list of scientific research reports with P578-2004 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)