F913-0774 Screening compound: 5-[(3,4-dimethoxyphenoxy)methyl]-N-[4-(propylcarbamoyl)phenyl]-1,3,4-thiadiazole-2-carboxamide

F913-0774 Screening compound: 5-[(3,4-dimethoxyphenoxy)methyl]-N-[4-(propylcarbamoyl)phenyl]-1,3,4-thiadiazole-2-carboxamide
F913-0774 Screening compound: 5-[(3,4-dimethoxyphenoxy)methyl]-N-[4-(propylcarbamoyl)phenyl]-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F913-0774
5-[(3,4-dimethoxyphenoxy)methyl]-N-[4-(propylcarbamoyl)phenyl]-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

F913-0774

Molecular Formula

C22H24N4O5S (C22 H24 N4 O5 S)

Compound Name

5-[(3,4-dimethoxyphenoxy)methyl]-N-[4-(propylcarbamoyl)phenyl]-1,3,4-thiadiazole-2-carboxamide

IUPAC name

5-[(34-dimethoxyphenoxy)methyl]-N-[4-(propylcarbamoyl)phenyl]-134-thiadiazole-2-carboxamide

SMILES

CCCNC(c(cc1)ccc1NC(c1nnc(COc(cc2)cc(OC)c2OC)s1)=O)=O

InChI

InChI=1S/C22H24N4O5S/c1-4-11-23-20(27)14-5-7-15(8-6-14)24-21(28)22-26-25-19(32-22)13-31-16-9-10-17(29-2)18(12-16)30-3/h5-10,12H,4,11,13H2,1-3H3,(H,23,27)(H,24,28)

InChI Key

MYPMFUKYCPRDRO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14970907

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.440

Distribution Coefficient, logD

2.433

Water Solubility, LogSw

-3.03

Polar Surface Area

94.344

Acid Dissociation Constant (pKa)

9.21

Base Dissociation Constant (pKb)

-1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with F913-0774 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F913-0774?
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What is the minimum amount of F913-0774 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F913-0774
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F913-0774
  • 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 F913-0774 available by request