8290-04130 Screening compound: N-[2-(4-ethylphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-2-methylbenzamide

8290-04130 Screening compound: N-[2-(4-ethylphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-2-methylbenzamide
8290-04130 Screening compound: N-[2-(4-ethylphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-2-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8290-04130
N-[2-(4-ethylphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-2-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

8290-04130

Molecular Formula

C23H22N4O (C23 H22 N4 O)

Compound Name

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

IUPAC name

N-[2-(4-ethylphenyl)-6-methyl-2H-123-benzotriazol-5-yl]-2-methylbenzamide

SMILES

CCc(cc1)ccc1-n1nc(cc(c(C)c2)NC(c3c(C)cccc3)=O)c2n1

InChI

InChI=1S/C23H22N4O/c1-4-17-9-11-18(12-10-17)27-25-21-13-16(3)20(14-22(21)26-27)24-23(28)19-8-6-5-7-15(19)2/h5-14H,4H2,1-3H3,(H,24,28)

InChI Key

RWFMAKHIFIYXQD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08572778

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.327

Distribution Coefficient, logD

5.245

Water Solubility, LogSw

-5.29

Polar Surface Area

46.666

Acid Dissociation Constant (pKa)

8.08

Base Dissociation Constant (pKb)

0.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

8290-04130 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8290-04130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8290-04130?
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What is the minimum amount of 8290-04130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8290-04130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8290-04130
  • 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 8290-04130 available by request