M508-0166 Screening compound: N-(cyclopropylmethyl)-2-{1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl}acetamide
Chemical Structure Depiction of ChemDiv screening compound M508-0166
N-(cyclopropylmethyl)-2-{1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-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
M508-0166
Molecular Formula
C15H19N3O (C15 H19 N3 O)
Compound Name
N-(cyclopropylmethyl)-2-{1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl}acetamide
IUPAC name
N-(cyclopropylmethyl)-2-{1-ethyl-1H-pyrrolo[23-b]pyridin-3-yl}acetamide
SMILES
CCn1c(nccc2)c2c(CC(NCC2CC2)=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
257.34
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
1.458
Distribution Coefficient, logD
1.452
Water Solubility, LogSw
-1.99
Polar Surface Area
36.597
Acid Dissociation Constant (pKa)
15.65
Base Dissociation Constant (pKb)
5.51
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
46.70
M508-0166 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
CNS MPO Library (28609 compounds)
Hsp90-Targeted Library (11355 compounds)
SmartTM Library (51161 compounds)
Epigenetics Focused Set (26518 compounds)
Included in 1.7M Stock Database
- Nervous system
- Cancer
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Immune system
References: we are preparing a list of scientific research reports with M508-0166 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)