S827-4037 Screening compound: 3-[2-(3-ethyl-1,2,4-oxadiazol-5-yl)-4,4-difluoropyrrolidine-1-carbonyl]pyridin-2-ol

S827-4037 Screening compound: 3-[2-(3-ethyl-1,2,4-oxadiazol-5-yl)-4,4-difluoropyrrolidine-1-carbonyl]pyridin-2-ol
S827-4037 Screening compound: 3-[2-(3-ethyl-1,2,4-oxadiazol-5-yl)-4,4-difluoropyrrolidine-1-carbonyl]pyridin-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound S827-4037
3-[2-(3-ethyl-1,2,4-oxadiazol-5-yl)-4,4-difluoropyrrolidine-1-carbonyl]pyridin-2-ol

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

S827-4037

Molecular Formula

C14H14F2N4O3 (C14 H14 F2 N4 O3)

Compound Name

3-[2-(3-ethyl-1,2,4-oxadiazol-5-yl)-4,4-difluoropyrrolidine-1-carbonyl]pyridin-2-ol

IUPAC name

3-[(2S)-2-(3-ethyl-124-oxadiazol-5-yl)-44-difluoropyrrolidine-1-carbonyl]pyridin-2-ol

SMILES

CCc1noc([C@H](CC(C2)(F)F)N2C(c(cccn2)c2O)=O)n1

InChI

InChI=1S/C14H14F2N4O3/c1-2-10-18-12(23-19-10)9-6-14(15,16)7-20(9)13(22)8-4-3-5-17-11(8)21/h3-5,9H,2,6-7H2,1H3,(H,17,21)/t9-/m1/s1

InChI Key

CBGIAINKAQIVAT-SECBINFHSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.29

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.392

Distribution Coefficient, logD

1.383

Water Solubility, LogSw

-2.23

Polar Surface Area

75.556

Acid Dissociation Constant (pKa)

9.10

Base Dissociation Constant (pKb)

0.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.86

References: we are preparing a list of scientific research reports with S827-4037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S827-4037?
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What is the minimum amount of S827-4037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S827-4037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S827-4037
  • 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 S827-4037 available by request