4168-2267 Screening compound: N-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]-3,4-dimethylbenzamide

4168-2267 Screening compound: N-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]-3,4-dimethylbenzamide
4168-2267 Screening compound: N-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]-3,4-dimethylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4168-2267
N-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]-3,4-dimethylbenzamide

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

4168-2267

Molecular Formula

C23H22N4O2 (C23 H22 N4 O2)

Compound Name

N-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]-3,4-dimethylbenzamide

IUPAC name

N-[2-(4-ethoxyphenyl)-2H-123-benzotriazol-5-yl]-34-dimethylbenzamide

SMILES

CCOc(cc1)ccc1-n1nc(cc(cc2)NC(c3cc(C)c(C)cc3)=O)c2n1

InChI

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

InChI Key

ZICXXRGNYYVELM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02051962

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

5.650

Distribution Coefficient, logD

5.589

Water Solubility, LogSw

-5.38

Polar Surface Area

54.487

Acid Dissociation Constant (pKa)

8.22

Base Dissociation Constant (pKb)

-0.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with 4168-2267 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4168-2267?
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What is the minimum amount of 4168-2267 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4168-2267
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4168-2267
  • 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 4168-2267 available by request