D336-7316 Screening compound: N-[4-acetyl-5-(5-chloro-2-ethoxyphenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide

D336-7316 Screening compound: N-[4-acetyl-5-(5-chloro-2-ethoxyphenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide
D336-7316 Screening compound: N-[4-acetyl-5-(5-chloro-2-ethoxyphenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D336-7316
N-[4-acetyl-5-(5-chloro-2-ethoxyphenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]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

D336-7316

Molecular Formula

C14H16ClN3O3S (C14 H16 ClN3 O3 S)

Compound Name

N-[4-acetyl-5-(5-chloro-2-ethoxyphenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide

IUPAC name

N-[4-acetyl-5-(5-chloro-2-ethoxyphenyl)-45-dihydro-134-thiadiazol-2-yl]acetamide

SMILES

CCOc(cc1)c(C2SC(NC(C)=O)=NN2C(C)=O)cc1Cl

InChI

InChI=1S/C14H16ClN3O3S/c1-4-21-12-6-5-10(15)7-11(12)13-18(9(3)20)17-14(22-13)16-8(2)19/h5-7,13H,4H2,1-3H3,(H,16,17,19)/t13-/m0/s1

InChI Key

JYYZDBMHDBYCFH-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD14820359

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.82

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.930

Distribution Coefficient, logD

2.884

Water Solubility, LogSw

-3.54

Polar Surface Area

58.353

Acid Dissociation Constant (pKa)

8.35

Base Dissociation Constant (pKb)

-1.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with D336-7316 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D336-7316?
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What is the minimum amount of D336-7316 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D336-7316
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D336-7316
  • 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 D336-7316 available by request