7388-0010 Screening compound: ethyl 4-[2-(3-oxopiperazin-2-yl)acetamido]benzoate
Chemical Structure Depiction of ChemDiv screening compound 7388-0010
ethyl 4-[2-(3-oxopiperazin-2-yl)acetamido]benzoate
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
7388-0010
Molecular Formula
C15H19N3O4 (C15 H19 N3 O4)
Compound Name
ethyl 4-[2-(3-oxopiperazin-2-yl)acetamido]benzoate
IUPAC name
ethyl 4-[2-(3-oxopiperazin-2-yl)acetamido]benzoate
SMILES
CCOC(c(cc1)ccc1NC(CC1NCCNC1=O)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
305.33
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
0.283
Distribution Coefficient, logD
-0.007
Water Solubility, LogSw
-1.75
Polar Surface Area
81.519
Acid Dissociation Constant (pKa)
10.76
Base Dissociation Constant (pKb)
7.38
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
40.00
7388-0010 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Human Proteases Annotated Library (2868 compounds)
Selective Target Activity Profiling Library (14702 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
References: we are preparing a list of scientific research reports with 7388-0010 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)