E002-1247 Screening compound: N-(4-ethoxyphenyl)-6-methyl-1-propyl-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-2-carboxamide
Chemical Structure Depiction of ChemDiv screening compound E002-1247
N-(4-ethoxyphenyl)-6-methyl-1-propyl-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-2-carboxamide
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
E002-1247
Molecular Formula
C20H27N3O2 (C20 H27 N3 O2)
Compound Name
N-(4-ethoxyphenyl)-6-methyl-1-propyl-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-2-carboxamide
IUPAC name
N-(4-ethoxyphenyl)-6-methyl-1-propyl-1H2H3H4H-pyrrolo[12-a]pyrazine-2-carboxamide
SMILES
CCCC(c1ccc(C)n1CC1)N1C(Nc(cc1)ccc1OCC)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
341.45
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.365
Distribution Coefficient, logD
4.365
Water Solubility, LogSw
-4.06
Polar Surface Area
33.482
Acid Dissociation Constant (pKa)
13.86
Base Dissociation Constant (pKb)
1.75
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
45.00
E002-1247 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with E002-1247 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)