L697-1109 Screening compound: 4-{[1-({5-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-1H-imidazol-4-yl]sulfonyl}morpholine

L697-1109 Screening compound: 4-{[1-({5-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-1H-imidazol-4-yl]sulfonyl}morpholine
L697-1109 Screening compound: 4-{[1-({5-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-1H-imidazol-4-yl]sulfonyl}morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound L697-1109
4-{[1-({5-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-1H-imidazol-4-yl]sulfonyl}morpholine

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

L697-1109

Molecular Formula

C17H18BrN5O4S (C17 H18 BrN5 O4 S)

Compound Name

4-{[1-({5-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-1H-imidazol-4-yl]sulfonyl}morpholine

IUPAC name

4-{[1-({5-[(4-bromophenyl)methyl]-124-oxadiazol-3-yl}methyl)-1H-imidazol-4-yl]sulfonyl}morpholine

SMILES

O=S(c1cn(Cc2noc(Cc(cc3)ccc3Br)n2)cn1)(N1CCOCC1)=O

InChI

InChI=1S/C17H18BrN5O4S/c18-14-3-1-13(2-4-14)9-16-20-15(21-27-16)10-22-11-17(19-12-22)28(24,25)23-5-7-26-8-6-23/h1-4,11-12H,5-10H2

InChI Key

DKZPFATZDJBYFB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27470614

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.33

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.086

Distribution Coefficient, logD

2.086

Water Solubility, LogSw

-2.43

Polar Surface Area

84.029

Acid Dissociation Constant (pKa)

28.37

Base Dissociation Constant (pKb)

0.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

L697-1109 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Targeted Diversity Library (40567 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with L697-1109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L697-1109?
Check Price and Availability of L697-1109, 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 L697-1109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L697-1109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L697-1109
  • 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 L697-1109 available by request