7840-4020 Screening compound: N-[2-(4-fluorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-3,4,5-trimethoxybenzamide

7840-4020 Screening compound: N-[2-(4-fluorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-3,4,5-trimethoxybenzamide
7840-4020 Screening compound: N-[2-(4-fluorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-3,4,5-trimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7840-4020
N-[2-(4-fluorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-3,4,5-trimethoxybenzamide

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

7840-4020

Molecular Formula

C23H21FN4O4 (C23 H21 FN4 O4)

Compound Name

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

IUPAC name

N-[2-(4-fluorophenyl)-6-methyl-2H-123-benzotriazol-5-yl]-345-trimethoxybenzamide

SMILES

Cc1cc2nn(-c(cc3)ccc3F)nc2cc1NC(c(cc1OC)cc(OC)c1OC)=O

InChI

InChI=1S/C23H21FN4O4/c1-13-9-18-19(27-28(26-18)16-7-5-15(24)6-8-16)12-17(13)25-23(29)14-10-20(30-2)22(32-4)21(11-14)31-3/h5-12H,1-4H3,(H,25,29)

InChI Key

VKBFPYBCPSXYCT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05851307

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.987

Distribution Coefficient, logD

3.986

Water Solubility, LogSw

-4.21

Polar Surface Area

69.644

Acid Dissociation Constant (pKa)

10.14

Base Dissociation Constant (pKb)

-0.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with 7840-4020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7840-4020?
Check Price and Availability of 7840-4020, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 7840-4020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7840-4020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7840-4020
  • 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 7840-4020 available by request