S695-1986 Screening compound: 2-[3-(2-methyl-1H-imidazol-1-yl)azetidine-1-carbonyl]-1H-indole

S695-1986 Screening compound: 2-[3-(2-methyl-1H-imidazol-1-yl)azetidine-1-carbonyl]-1H-indole
S695-1986 Screening compound: 2-[3-(2-methyl-1H-imidazol-1-yl)azetidine-1-carbonyl]-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound S695-1986
2-[3-(2-methyl-1H-imidazol-1-yl)azetidine-1-carbonyl]-1H-indole

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

S695-1986

Molecular Formula

C16H16N4O (C16 H16 N4 O)

Compound Name

2-[3-(2-methyl-1H-imidazol-1-yl)azetidine-1-carbonyl]-1H-indole

IUPAC name

2-[3-(2-methyl-1H-imidazol-1-yl)azetidine-1-carbonyl]-1H-indole

SMILES

Cc1nccn1C(C1)CN1C(c1cc(cccc2)c2[nH]1)=O

InChI

InChI=1S/C16H16N4O/c1-11-17-6-7-20(11)13-9-19(10-13)16(21)15-8-12-4-2-3-5-14(12)18-15/h2-8,13,18H,9-10H2,1H3

InChI Key

JVDRTIHZHAUOON-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31995637

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

280.33

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.833

Distribution Coefficient, logD

0.519

Water Solubility, LogSw

-2.45

Polar Surface Area

38.820

Acid Dissociation Constant (pKa)

15.36

Base Dissociation Constant (pKb)

8.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

S695-1986 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with S695-1986 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S695-1986?
Check Price and Availability of S695-1986, 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 S695-1986 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S695-1986
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S695-1986
  • 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 S695-1986 available by request