F854-0892 Screening compound: N-(3-{[(4-ethoxyphenyl)methyl]carbamoyl}phenyl)-5-(2-methylpropyl)-1,3,4-thiadiazole-2-carboxamide

F854-0892 Screening compound: N-(3-{[(4-ethoxyphenyl)methyl]carbamoyl}phenyl)-5-(2-methylpropyl)-1,3,4-thiadiazole-2-carboxamide
F854-0892 Screening compound: N-(3-{[(4-ethoxyphenyl)methyl]carbamoyl}phenyl)-5-(2-methylpropyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F854-0892
N-(3-{[(4-ethoxyphenyl)methyl]carbamoyl}phenyl)-5-(2-methylpropyl)-1,3,4-thiadiazole-2-carboxamide

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

F854-0892

Molecular Formula

C23H26N4O3S (C23 H26 N4 O3 S)

Compound Name

N-(3-{[(4-ethoxyphenyl)methyl]carbamoyl}phenyl)-5-(2-methylpropyl)-1,3,4-thiadiazole-2-carboxamide

IUPAC name

N-(3-{[(4-ethoxyphenyl)methyl]carbamoyl}phenyl)-5-(2-methylpropyl)-134-thiadiazole-2-carboxamide

SMILES

CCOc1ccc(CNC(c2cccc(NC(c3nnc(CC(C)C)s3)=O)c2)=O)cc1

InChI

InChI=1S/C23H26N4O3S/c1-4-30-19-10-8-16(9-11-19)14-24-21(28)17-6-5-7-18(13-17)25-22(29)23-27-26-20(31-23)12-15(2)3/h5-11,13,15H,4,12,14H2,1-3H3,(H,24,28)(H,25,29)

InChI Key

YCLJNAAZCXPSCK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14968055

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.459

Distribution Coefficient, logD

4.459

Water Solubility, LogSw

-4.20

Polar Surface Area

78.866

Acid Dissociation Constant (pKa)

11.03

Base Dissociation Constant (pKb)

-2.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with F854-0892 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F854-0892?
Check Price and Availability of F854-0892, 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 F854-0892 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F854-0892
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F854-0892
  • 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 F854-0892 available by request