S372-0138 Screening compound: 2-{1-oxo-1H,2H,7H,8H,9H,10H-pyrazino[1,2-b]indazol-2-yl}-N-(4-phenylbutan-2-yl)acetamide
Chemical Structure Depiction of ChemDiv screening compound S372-0138
2-{1-oxo-1H,2H,7H,8H,9H,10H-pyrazino[1,2-b]indazol-2-yl}-N-(4-phenylbutan-2-yl)acetamide
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
S372-0138
Molecular Formula
C22H26N4O2 (C22 H26 N4 O2)
Compound Name
2-{1-oxo-1H,2H,7H,8H,9H,10H-pyrazino[1,2-b]indazol-2-yl}-N-(4-phenylbutan-2-yl)acetamide
IUPAC name
2-{1-oxo-1H2H7H8H9H10H-pyrazino[12-b]indazol-2-yl}-N-(4-phenylbutan-2-yl)acetamide
SMILES
CC(CCc1ccccc1)NC(CN(C=Cn1nc(CCCC2)c2c11)C1=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
378.47
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.134
Distribution Coefficient, logD
2.134
Water Solubility, LogSw
-2.51
Polar Surface Area
53.352
Acid Dissociation Constant (pKa)
15.26
Base Dissociation Constant (pKb)
1.12
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
40.90
S372-0138 in Drug Discovery
Included in Screening Libraries
Ligand-Gated Ion Channels Library (3887 compounds)
PPI Inhibitors Tripeptide Mimetics (23972 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
MDM2-p53 interaction inhibitors Library (21687 compounds)
Included in 1.7M Stock Database
- Nervous system
- Eye
- Cancer
- Ion Channels
- PPI modulators
- PPI modulators
- PPI modulators
- Mimetics
- Cyclic compounds
References: we are preparing a list of scientific research reports with S372-0138 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of S372-0138, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
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)