G817-0317 Screening compound: N-(2-ethylphenyl)-N-methyl-1-(morpholin-4-yl)isoquinoline-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound G817-0317
N-(2-ethylphenyl)-N-methyl-1-(morpholin-4-yl)isoquinoline-4-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
G817-0317
Molecular Formula
C23H25N3O2 (C23 H25 N3 O2)
Compound Name
N-(2-ethylphenyl)-N-methyl-1-(morpholin-4-yl)isoquinoline-4-carboxamide
IUPAC name
N-(2-ethylphenyl)-N-methyl-1-(morpholin-4-yl)isoquinoline-4-carboxamide
SMILES
CCc(cccc1)c1N(C)C(c(c1ccccc11)cnc1N1CCOCC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
375.47
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.239
Distribution Coefficient, logD
4.234
Water Solubility, LogSw
-3.98
Polar Surface Area
35.466
Acid Dissociation Constant (pKa)
23.86
Base Dissociation Constant (pKb)
5.42
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
30.40
G817-0317 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
CNS BBB Library (22607 compounds)
PI3K-Targeted Library (17255 compounds)
Selective Target Activity Profiling Library (14702 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- Cancer
- Nervous system
- Nervous system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Kinases
References: we are preparing a list of scientific research reports with G817-0317 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)