7840-3834 Screening compound: N-[2-(3-chloro-4-methylphenyl)-2H-1,2,3-benzotriazol-5-yl]-2,6-dimethoxybenzamide

7840-3834 Screening compound: N-[2-(3-chloro-4-methylphenyl)-2H-1,2,3-benzotriazol-5-yl]-2,6-dimethoxybenzamide
7840-3834 Screening compound: N-[2-(3-chloro-4-methylphenyl)-2H-1,2,3-benzotriazol-5-yl]-2,6-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7840-3834
N-[2-(3-chloro-4-methylphenyl)-2H-1,2,3-benzotriazol-5-yl]-2,6-dimethoxybenzamide

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

7840-3834

Molecular Formula

C22H19ClN4O3 (C22 H19 ClN4 O3)

Compound Name

N-[2-(3-chloro-4-methylphenyl)-2H-1,2,3-benzotriazol-5-yl]-2,6-dimethoxybenzamide

IUPAC name

N-[2-(3-chloro-4-methylphenyl)-2H-123-benzotriazol-5-yl]-26-dimethoxybenzamide

SMILES

Cc(ccc(-n1nc(cc(cc2)NC(c(c(OC)ccc3)c3OC)=O)c2n1)c1)c1Cl

InChI

InChI=1S/C22H19ClN4O3/c1-13-7-9-15(12-16(13)23)27-25-17-10-8-14(11-18(17)26-27)24-22(28)21-19(29-2)5-4-6-20(21)30-3/h4-12H,1-3H3,(H,24,28)

InChI Key

WJMXAOKVPWIANS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05851124

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.87

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.042

Distribution Coefficient, logD

3.906

Water Solubility, LogSw

-5.60

Polar Surface Area

62.625

Acid Dissociation Constant (pKa)

6.30

Base Dissociation Constant (pKb)

0.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

References: we are preparing a list of scientific research reports with 7840-3834 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7840-3834?
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What is the minimum amount of 7840-3834 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7840-3834
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7840-3834
  • 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 7840-3834 available by request