D323-0097 Screening compound: N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]propanamide

D323-0097 Screening compound: N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]propanamide
D323-0097 Screening compound: N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D323-0097
N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]propanamide

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

D323-0097

Molecular Formula

C11H10BrN3OS (C11 H10 BrN3 OS)

Compound Name

N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]propanamide

IUPAC name

N-[3-(4-bromophenyl)-124-thiadiazol-5-yl]propanamide

SMILES

CCC(Nc1nc(-c(cc2)ccc2Br)ns1)=O

InChI

InChI=1S/C11H10BrN3OS/c1-2-9(16)13-11-14-10(15-17-11)7-3-5-8(12)6-4-7/h3-6H,2H2,1H3,(H,13,14,15,16)

InChI Key

ZIDSGNISZHNZHR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08549564

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.19

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.644

Distribution Coefficient, logD

3.643

Water Solubility, LogSw

-3.81

Polar Surface Area

43.975

Acid Dissociation Constant (pKa)

10.82

Base Dissociation Constant (pKb)

-4.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

D323-0097 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 D323-0097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D323-0097?
Check Price and Availability of D323-0097, 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 D323-0097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D323-0097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D323-0097
  • 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 D323-0097 available by request