G603-0262 Screening compound: 3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1-(thiophene-2-sulfonyl)piperidine

G603-0262 Screening compound: 3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1-(thiophene-2-sulfonyl)piperidine
G603-0262 Screening compound: 3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1-(thiophene-2-sulfonyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound G603-0262
3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1-(thiophene-2-sulfonyl)piperidine

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

G603-0262

Molecular Formula

C18H17N3O5S2 (C18 H17 N3 O5 S2)

Compound Name

3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1-(thiophene-2-sulfonyl)piperidine

IUPAC name

3-[3-(2H-13-benzodioxol-5-yl)-124-oxadiazol-5-yl]-1-(thiophene-2-sulfonyl)piperidine

SMILES

O=S(c1cccs1)(N(CCC1)CC1c1nc(-c(cc2)cc3c2OCO3)no1)=O

InChI

InChI=1S/C18H17N3O5S2/c22-28(23,16-4-2-8-27-16)21-7-1-3-13(10-21)18-19-17(20-26-18)12-5-6-14-15(9-12)25-11-24-14/h2,4-6,8-9,13H,1,3,7,10-11H2/t13-/m0/s1

InChI Key

AZLVQNOUDHSCCV-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD15022454

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.841

Distribution Coefficient, logD

3.841

Water Solubility, LogSw

-4.01

Polar Surface Area

81.422

Acid Dissociation Constant (pKa)

26.18

Base Dissociation Constant (pKb)

-3.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

G603-0262 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G603-0262 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G603-0262?
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What is the minimum amount of G603-0262 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G603-0262
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G603-0262
  • 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 G603-0262 available by request