V002-7553 Screening compound: N~2~-(4-{3-(2-methoxyethoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2-naphthamide

V002-7553 Screening compound: N~2~-(4-{3-(2-methoxyethoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2-naphthamide
V002-7553 Screening compound: N~2~-(4-{3-(2-methoxyethoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2-naphthamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-7553
N~2~-(4-{3-(2-methoxyethoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2-naphthamide

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

V002-7553

Molecular Formula

C29H23F3N4O3 (C29 H23 F3 N4 O3)

Compound Name

N~2~-(4-{3-(2-methoxyethoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2-naphthamide

IUPAC name

N-{4-[3-(2-methoxyethoxy)-5-[3-(trifluoromethyl)phenyl]-1H-124-triazol-1-yl]phenyl}naphthalene-2-carboxamide

SMILES

COCCOc(nc1-c2cccc(C(F)(F)F)c2)nn1-c(cc1)ccc1NC(c1cc2ccccc2cc1)=O

InChI

InChI=1S/C29H23F3N4O3/c1-38-15-16-39-28-34-26(21-7-4-8-23(18-21)29(30,31)32)36(35-28)25-13-11-24(12-14-25)33-27(37)22-10-9-19-5-2-3-6-20(19)17-22/h2-14,17-18H,15-16H2,1H3,(H,33,37)

InChI Key

YSQJQGUMCJSZEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19758537

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

532.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.241

Distribution Coefficient, logD

6.241

Water Solubility, LogSw

-6.56

Polar Surface Area

62.270

Acid Dissociation Constant (pKa)

11.21

Base Dissociation Constant (pKb)

-0.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.79

References: we are preparing a list of scientific research reports with V002-7553 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-7553?
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What is the minimum amount of V002-7553 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-7553
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-7553
  • 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 V002-7553 available by request