SC07-0764 Screening compound: N-{1-[(3-fluorobenzyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-N-[2-(5-isopropyl-1,2,4-oxadiazol-3-yl)ethyl]acetamide

SC07-0764 Screening compound: N-{1-[(3-fluorobenzyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-N-[2-(5-isopropyl-1,2,4-oxadiazol-3-yl)ethyl]acetamide
SC07-0764 Screening compound: N-{1-[(3-fluorobenzyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-N-[2-(5-isopropyl-1,2,4-oxadiazol-3-yl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC07-0764
N-{1-[(3-fluorobenzyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-N-[2-(5-isopropyl-1,2,4-oxadiazol-3-yl)ethyl]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

SC07-0764

Molecular Formula

C20H27FN4O4S (C20 H27 FN4 O4 S)

Compound Name

N-{1-[(3-fluorobenzyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-N-[2-(5-isopropyl-1,2,4-oxadiazol-3-yl)ethyl]acetamide

IUPAC name

N-{1-[(3-fluorophenyl)methanesulfonyl]pyrrolidin-3-yl}-N-{2-[5-(propan-2-yl)-124-oxadiazol-3-yl]ethyl}acetamide

SMILES

CC(C)c1nc(CCN(C(CC2)CN2S(Cc2cc(F)ccc2)(=O)=O)C(C)=O)no1

InChI

InChI=1S/C20H27FN4O4S/c1-14(2)20-22-19(23-29-20)8-10-25(15(3)26)18-7-9-24(12-18)30(27,28)13-16-5-4-6-17(21)11-16/h4-6,11,14,18H,7-10,12-13H2,1-3H3/t18-/m1/s1

InChI Key

VNKWUVCMRQVFSF-GOSISDBHSA-N

MDL Number (MFCD)

MFCD32254628

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.52

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.527

Distribution Coefficient, logD

2.527

Water Solubility, LogSw

-2.65

Polar Surface Area

80.792

Acid Dissociation Constant (pKa)

20.21

Base Dissociation Constant (pKb)

-1.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.00

SC07-0764 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SC07-0764 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC07-0764?
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What is the minimum amount of SC07-0764 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC07-0764
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC07-0764
  • 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 SC07-0764 available by request