F484-1048 Screening compound: 2-(2-chlorophenyl)-N-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}acetamide

F484-1048 Screening compound: 2-(2-chlorophenyl)-N-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}acetamide
F484-1048 Screening compound: 2-(2-chlorophenyl)-N-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F484-1048
2-(2-chlorophenyl)-N-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}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

F484-1048

Molecular Formula

C18H15ClF3N3O (C18 H15 ClF3 N3 O)

Compound Name

2-(2-chlorophenyl)-N-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}acetamide

IUPAC name

2-(2-chlorophenyl)-N-{2-[2-(trifluoromethyl)-1H-13-benzodiazol-1-yl]ethyl}acetamide

SMILES

O=C(Cc(cccc1)c1Cl)NCCn1c(cccc2)c2nc1C(F)(F)F

InChI

InChI=1S/C18H15ClF3N3O/c19-13-6-2-1-5-12(13)11-16(26)23-9-10-25-15-8-4-3-7-14(15)24-17(25)18(20,21)22/h1-8H,9-11H2,(H,23,26)

InChI Key

XIGCXGIJCCYOIB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27133604

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.78

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.212

Distribution Coefficient, logD

4.212

Water Solubility, LogSw

-4.31

Polar Surface Area

34.458

Acid Dissociation Constant (pKa)

13.96

Base Dissociation Constant (pKb)

0.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

F484-1048 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with F484-1048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F484-1048?
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What is the minimum amount of F484-1048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F484-1048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F484-1048
  • 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 F484-1048 available by request