D284-0285 Screening compound: N-ETHYL-4-[5-(4-FLUOROPHENYL)-1H-1,2,4-TRIAZOL-3-YL]-1-[(2-FLUOROPHENYL)METHYL]-1H-1,2,3-TRIAZOL-5-AMINE

D284-0285 Screening compound: N-ETHYL-4-[5-(4-FLUOROPHENYL)-1H-1,2,4-TRIAZOL-3-YL]-1-[(2-FLUOROPHENYL)METHYL]-1H-1,2,3-TRIAZOL-5-AMINE
D284-0285 Screening compound: N-ETHYL-4-[5-(4-FLUOROPHENYL)-1H-1,2,4-TRIAZOL-3-YL]-1-[(2-FLUOROPHENYL)METHYL]-1H-1,2,3-TRIAZOL-5-AMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound D284-0285
N-ETHYL-4-[5-(4-FLUOROPHENYL)-1H-1,2,4-TRIAZOL-3-YL]-1-[(2-FLUOROPHENYL)METHYL]-1H-1,2,3-TRIAZOL-5-AMINE

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

D284-0285

Molecular Formula

C19H17F2N7 (C19 H17 F2 N7)

Compound Name

N-ETHYL-4-[5-(4-FLUOROPHENYL)-1H-1,2,4-TRIAZOL-3-YL]-1-[(2-FLUOROPHENYL)METHYL]-1H-1,2,3-TRIAZOL-5-AMINE

IUPAC name

n/a

SMILES

CCNc1c(-c2n[nH]c(-c(cc3)ccc3F)n2)nnn1Cc(cccc1)c1F

InChI

InChI=1S/C19H17F2N7/c1-2-22-19-16(24-27-28(19)11-13-5-3-4-6-15(13)21)18-23-17(25-26-18)12-7-9-14(20)10-8-12/h3-10,22H,2,11H2,1H3,(H,23,25,26)

InChI Key

ADXKBAKQOHLQCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14816763

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.662

Distribution Coefficient, logD

3.636

Water Solubility, LogSw

-3.74

Polar Surface Area

70.262

Acid Dissociation Constant (pKa)

4.75

Base Dissociation Constant (pKb)

0.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

D284-0285 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with D284-0285 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D284-0285?
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What is the minimum amount of D284-0285 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D284-0285
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D284-0285
  • 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 D284-0285 available by request