6773-1364 Screening compound: 2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide

6773-1364 Screening compound: 2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
6773-1364 Screening compound: 2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6773-1364
2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]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

6773-1364

Molecular Formula

C13H12F3N5OS (C13 H12 F3 N5 OS)

Compound Name

2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide

IUPAC name

2-[(46-diaminopyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide

SMILES

Nc1nc(SCC(Nc2cc(C(F)(F)F)ccc2)=O)nc(N)c1

InChI

InChI=1S/C13H12F3N5OS/c14-13(15,16)7-2-1-3-8(4-7)19-11(22)6-23-12-20-9(17)5-10(18)21-12/h1-5H,6H2,(H,19,22)(H4,17,18,20,21)

InChI Key

QHQKEFPPMPBIFN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01835725

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

5.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.548

Distribution Coefficient, logD

2.547

Water Solubility, LogSw

-3.05

Polar Surface Area

81.682

Acid Dissociation Constant (pKa)

10.42

Base Dissociation Constant (pKb)

3.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

6773-1364 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6773-1364 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6773-1364?
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What is the minimum amount of 6773-1364 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6773-1364
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6773-1364
  • 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 6773-1364 available by request