P593-0609 Screening compound: 3-{[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl}-1-propyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of ChemDiv screening compound P593-0609
3-{[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl}-1-propyl-1H-pyrazole-4-carboxylic acid
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
P593-0609
Molecular Formula
C17H21ClN4O4S (C17 H21 ClN4 O4 S)
Compound Name
3-{[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl}-1-propyl-1H-pyrazole-4-carboxylic acid
IUPAC name
3-{[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl}-1-propyl-1H-pyrazole-4-carboxylic acid
SMILES
CCCn(cc1C(O)=O)nc1S(N(CC1)CCN1c(cc1)ccc1Cl)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
412.9
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.778
Distribution Coefficient, logD
-1.329
Water Solubility, LogSw
-3.32
Polar Surface Area
78.695
Acid Dissociation Constant (pKa)
3.29
Base Dissociation Constant (pKb)
1.44
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
41.18
P593-0609 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Agro
References: we are preparing a list of scientific research reports with P593-0609 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)