3793-3653 Screening compound: 2-(2-tert-butyl-4-methylphenoxy)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide

3793-3653 Screening compound: 2-(2-tert-butyl-4-methylphenoxy)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
3793-3653 Screening compound: 2-(2-tert-butyl-4-methylphenoxy)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3793-3653
2-(2-tert-butyl-4-methylphenoxy)-N-[5-(propan-2-yl)-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

3793-3653

Molecular Formula

C18H25N3O2S (C18 H25 N3 O2 S)

Compound Name

2-(2-tert-butyl-4-methylphenoxy)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide

IUPAC name

2-(2-tert-butyl-4-methylphenoxy)-N-[5-(propan-2-yl)-134-thiadiazol-2-yl]acetamide

SMILES

CC(C)c1nnc(NC(COc2c(C(C)(C)C)cc(C)cc2)=O)s1

InChI

InChI=1S/C18H25N3O2S/c1-11(2)16-20-21-17(24-16)19-15(22)10-23-14-8-7-12(3)9-13(14)18(4,5)6/h7-9,11H,10H2,1-6H3,(H,19,21,22)

InChI Key

OMLFONHZQHLHFX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02356473

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.796

Distribution Coefficient, logD

4.736

Water Solubility, LogSw

-4.54

Polar Surface Area

54.247

Acid Dissociation Constant (pKa)

8.22

Base Dissociation Constant (pKb)

-3.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with 3793-3653 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3793-3653?
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What is the minimum amount of 3793-3653 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3793-3653
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3793-3653
  • 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 3793-3653 available by request