8290-04195 Screening compound: N-[2-(4-fluorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-2-methoxybenzamide

8290-04195 Screening compound: N-[2-(4-fluorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-2-methoxybenzamide
8290-04195 Screening compound: N-[2-(4-fluorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-2-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8290-04195
N-[2-(4-fluorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-2-methoxybenzamide

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

8290-04195

Molecular Formula

C21H17FN4O2 (C21 H17 FN4 O2)

Compound Name

N-[2-(4-fluorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-2-methoxybenzamide

IUPAC name

N-[2-(4-fluorophenyl)-6-methyl-2H-123-benzotriazol-5-yl]-2-methoxybenzamide

SMILES

Cc1cc2nn(-c(cc3)ccc3F)nc2cc1NC(c(cccc1)c1OC)=O

InChI

InChI=1S/C21H17FN4O2/c1-13-11-18-19(25-26(24-18)15-9-7-14(22)8-10-15)12-17(13)23-21(27)16-5-3-4-6-20(16)28-2/h3-12H,1-2H3,(H,23,27)

InChI Key

ZGWVHWHSCSLFJT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08575374

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.031

Distribution Coefficient, logD

3.699

Water Solubility, LogSw

-4.25

Polar Surface Area

54.296

Acid Dissociation Constant (pKa)

7.34

Base Dissociation Constant (pKb)

-0.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

References: we are preparing a list of scientific research reports with 8290-04195 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8290-04195?
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What is the minimum amount of 8290-04195 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8290-04195
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8290-04195
  • 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 8290-04195 available by request