S738-0998 Screening compound: 3-{3-[1-(cyclopropylmethyl)-5-methyl-1H-imidazol-2-yl]azetidine-1-carbonyl}-2,6-dimethoxypyridine

S738-0998 Screening compound: 3-{3-[1-(cyclopropylmethyl)-5-methyl-1H-imidazol-2-yl]azetidine-1-carbonyl}-2,6-dimethoxypyridine
S738-0998 Screening compound: 3-{3-[1-(cyclopropylmethyl)-5-methyl-1H-imidazol-2-yl]azetidine-1-carbonyl}-2,6-dimethoxypyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound S738-0998
3-{3-[1-(cyclopropylmethyl)-5-methyl-1H-imidazol-2-yl]azetidine-1-carbonyl}-2,6-dimethoxypyridine

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

S738-0998

Molecular Formula

C19H24N4O3 (C19 H24 N4 O3)

Compound Name

3-{3-[1-(cyclopropylmethyl)-5-methyl-1H-imidazol-2-yl]azetidine-1-carbonyl}-2,6-dimethoxypyridine

IUPAC name

3-{3-[1-(cyclopropylmethyl)-5-methyl-1H-imidazol-2-yl]azetidine-1-carbonyl}-26-dimethoxypyridine

SMILES

Cc1cnc(C(C2)CN2C(c(ccc(OC)n2)c2OC)=O)n1CC1CC1

InChI

InChI=1S/C19H24N4O3/c1-12-8-20-17(23(12)9-13-4-5-13)14-10-22(11-14)19(24)15-6-7-16(25-2)21-18(15)26-3/h6-8,13-14H,4-5,9-11H2,1-3H3

InChI Key

MJJORBKPPCUPPE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32227104

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.878

Distribution Coefficient, logD

2.609

Water Solubility, LogSw

-2.94

Polar Surface Area

52.882

Acid Dissociation Constant (pKa)

25.05

Base Dissociation Constant (pKb)

7.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.63

S738-0998 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with S738-0998 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S738-0998?
Check Price and Availability of S738-0998, 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.
What is the minimum amount of S738-0998 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S738-0998
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S738-0998
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of S738-0998 available by request