D350-2066 Screening compound: 4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]butanamide

D350-2066 Screening compound: 4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]butanamide
D350-2066 Screening compound: 4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D350-2066
4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]butanamide

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

D350-2066

Molecular Formula

C17H18ClN5O2S (C17 H18 ClN5 O2 S)

Compound Name

4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]butanamide

IUPAC name

4-[3-(4-chlorophenyl)-124-oxadiazol-5-yl]-N-[5-(propan-2-yl)-134-thiadiazol-2-yl]butanamide

SMILES

CC(C)c1nnc(NC(CCCc2nc(-c(cc3)ccc3Cl)no2)=O)s1

InChI

InChI=1S/C17H18ClN5O2S/c1-10(2)16-21-22-17(26-16)19-13(24)4-3-5-14-20-15(23-25-14)11-6-8-12(18)9-7-11/h6-10H,3-5H2,1-2H3,(H,19,22,24)

InChI Key

MWOXMQWGRITTFN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14822005

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.88

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.394

Distribution Coefficient, logD

4.312

Water Solubility, LogSw

-4.58

Polar Surface Area

78.004

Acid Dissociation Constant (pKa)

8.08

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

D350-2066 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D350-2066 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D350-2066?
Check Price and Availability of D350-2066, 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 D350-2066 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D350-2066
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D350-2066
  • 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 D350-2066 available by request