SA18-0630 Screening compound: 7-(2-methoxyethyl)-2-(1,2,3,4-tetrahydroisoquinoline-2-carbonyl)-5H,6H,7H,8H-imidazo[1,2-a]pyrazin-8-one
Chemical Structure Depiction of ChemDiv screening compound SA18-0630
7-(2-methoxyethyl)-2-(1,2,3,4-tetrahydroisoquinoline-2-carbonyl)-5H,6H,7H,8H-imidazo[1,2-a]pyrazin-8-one
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
SA18-0630
Molecular Formula
C19H22N4O3 (C19 H22 N4 O3)
Compound Name
7-(2-methoxyethyl)-2-(1,2,3,4-tetrahydroisoquinoline-2-carbonyl)-5H,6H,7H,8H-imidazo[1,2-a]pyrazin-8-one
IUPAC name
7-(2-methoxyethyl)-2-(1234-tetrahydroisoquinoline-2-carbonyl)-5H6H7H8H-imidazo[12-a]pyrazin-8-one
SMILES
COCCN(CCn1c2nc(C(N(CC3)Cc4c3cccc4)=O)c1)C2=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
354.41
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
1.142
Distribution Coefficient, logD
1.142
Water Solubility, LogSw
-1.83
Polar Surface Area
53.459
Acid Dissociation Constant (pKa)
20.34
Base Dissociation Constant (pKb)
-2.68
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
42.10
SA18-0630 in Drug Discovery
Included in Screening Libraries
PPI Helix Turn 3D-Mimetics Library (71298 compounds)
Protein-Protein Interaction Library (218420 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- Mimetics
References: we are preparing a list of scientific research reports with SA18-0630 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)