4239-0368 Screening compound: N-(2-methoxy-5-nitrophenyl)-3-(4-phenylpiperazin-1-yl)propanamide
Chemical Structure Depiction of ChemDiv screening compound 4239-0368
N-(2-methoxy-5-nitrophenyl)-3-(4-phenylpiperazin-1-yl)propanamide
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
4239-0368
Molecular Formula
C20H24N4O4 (C20 H24 N4 O4)
Compound Name
N-(2-methoxy-5-nitrophenyl)-3-(4-phenylpiperazin-1-yl)propanamide
IUPAC name
N-(2-methoxy-5-nitrophenyl)-3-(4-phenylpiperazin-1-yl)propanamide
SMILES
COc(ccc([N+]([O-])=O)c1)c1NC(CCN(CC1)CCN1c1ccccc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
384.44
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.454
Distribution Coefficient, logD
2.382
Water Solubility, LogSw
-3.02
Polar Surface Area
70.673
Acid Dissociation Constant (pKa)
8.65
Base Dissociation Constant (pKb)
6.47
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
35.00
4239-0368 in Drug Discovery
Included in Screening Libraries
CNS Annotated Library (688 compounds)
Human GPCR Annotated Library (5539 compounds)
Selective Target Activity Profiling Library (14702 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with 4239-0368 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)