8290-04064 Screening compound: N-[2-(4-ethylphenyl)-2H-1,2,3-benzotriazol-5-yl]-2-methoxy-3-methylbenzamide

8290-04064 Screening compound: N-[2-(4-ethylphenyl)-2H-1,2,3-benzotriazol-5-yl]-2-methoxy-3-methylbenzamide
8290-04064 Screening compound: N-[2-(4-ethylphenyl)-2H-1,2,3-benzotriazol-5-yl]-2-methoxy-3-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8290-04064
N-[2-(4-ethylphenyl)-2H-1,2,3-benzotriazol-5-yl]-2-methoxy-3-methylbenzamide

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

8290-04064

Molecular Formula

C23H22N4O2 (C23 H22 N4 O2)

Compound Name

N-[2-(4-ethylphenyl)-2H-1,2,3-benzotriazol-5-yl]-2-methoxy-3-methylbenzamide

IUPAC name

N-[2-(4-ethylphenyl)-2H-123-benzotriazol-5-yl]-2-methoxy-3-methylbenzamide

SMILES

CCc(cc1)ccc1-n1nc(cc(cc2)NC(c(cccc3C)c3OC)=O)c2n1

InChI

InChI=1S/C23H22N4O2/c1-4-16-8-11-18(12-9-16)27-25-20-13-10-17(14-21(20)26-27)24-23(28)19-7-5-6-15(2)22(19)29-3/h5-14H,4H2,1-3H3,(H,24,28)

InChI Key

PNQZWSSSIUYLFE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09453748

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.635

Distribution Coefficient, logD

5.118

Water Solubility, LogSw

-5.43

Polar Surface Area

55.081

Acid Dissociation Constant (pKa)

7.04

Base Dissociation Constant (pKb)

0.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with 8290-04064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8290-04064?
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What is the minimum amount of 8290-04064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8290-04064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8290-04064
  • 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 8290-04064 available by request