2237-0576 Screening compound: N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-3,4-dichlorobenzamide

2237-0576 Screening compound: N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-3,4-dichlorobenzamide
2237-0576 Screening compound: N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-3,4-dichlorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2237-0576
N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-3,4-dichlorobenzamide

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

2237-0576

Molecular Formula

C19H17Cl2N3OS (C19 H17 Cl2 N3 OS)

Compound Name

N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-3,4-dichlorobenzamide

IUPAC name

N-[5-(4-tert-butylphenyl)-134-thiadiazol-2-yl]-34-dichlorobenzamide

SMILES

CC(C)(C)c(cc1)ccc1-c1nnc(NC(c(cc2)cc(Cl)c2Cl)=O)s1

InChI

InChI=1S/C19H17Cl2N3OS/c1-19(2,3)13-7-4-11(5-8-13)17-23-24-18(26-17)22-16(25)12-6-9-14(20)15(21)10-12/h4-10H,1-3H3,(H,22,24,25)

InChI Key

LWDBXWAVADFMEZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01131479

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.909

Distribution Coefficient, logD

6.643

Water Solubility, LogSw

-6.63

Polar Surface Area

46.603

Acid Dissociation Constant (pKa)

7.47

Base Dissociation Constant (pKb)

-3.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

References: we are preparing a list of scientific research reports with 2237-0576 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2237-0576?
Check Price and Availability of 2237-0576, 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 2237-0576 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2237-0576
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2237-0576
  • 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 2237-0576 available by request