S715-3068 Screening compound: 2-cyclohexyl-1-{3-[3-(1-methyl-1H-pyrrol-2-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one

S715-3068 Screening compound: 2-cyclohexyl-1-{3-[3-(1-methyl-1H-pyrrol-2-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one
S715-3068 Screening compound: 2-cyclohexyl-1-{3-[3-(1-methyl-1H-pyrrol-2-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S715-3068
2-cyclohexyl-1-{3-[3-(1-methyl-1H-pyrrol-2-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one

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

S715-3068

Molecular Formula

C19H26N4O2 (C19 H26 N4 O2)

Compound Name

2-cyclohexyl-1-{3-[3-(1-methyl-1H-pyrrol-2-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one

IUPAC name

2-cyclohexyl-1-{3-[3-(1-methyl-1H-pyrrol-2-yl)-124-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one

SMILES

Cn1c(-c2noc(C(CC3)CN3C(CC3CCCCC3)=O)n2)ccc1

InChI

InChI=1S/C19H26N4O2/c1-22-10-5-8-16(22)18-20-19(25-21-18)15-9-11-23(13-15)17(24)12-14-6-3-2-4-7-14/h5,8,10,14-15H,2-4,6-7,9,11-13H2,1H3/t15-/m1/s1

InChI Key

NYNAXXYVQDCOJO-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD32226438

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.492

Distribution Coefficient, logD

4.492

Water Solubility, LogSw

-4.26

Polar Surface Area

50.673

Acid Dissociation Constant (pKa)

24.28

Base Dissociation Constant (pKb)

-2.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.16

S715-3068 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with S715-3068 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S715-3068?
Check Price and Availability of S715-3068, 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 S715-3068 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S715-3068
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S715-3068
  • 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 S715-3068 available by request