V016-3183 Screening compound: 3-bromo-N-({2-[(2,3-dimethylphenoxy)methyl]-1,3-thiazol-4-yl}methyl)-N-ethylbenzamide

V016-3183 Screening compound: 3-bromo-N-({2-[(2,3-dimethylphenoxy)methyl]-1,3-thiazol-4-yl}methyl)-N-ethylbenzamide
V016-3183 Screening compound: 3-bromo-N-({2-[(2,3-dimethylphenoxy)methyl]-1,3-thiazol-4-yl}methyl)-N-ethylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-3183
3-bromo-N-({2-[(2,3-dimethylphenoxy)methyl]-1,3-thiazol-4-yl}methyl)-N-ethylbenzamide

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

V016-3183

Molecular Formula

C22H23BrN2O2S (C22 H23 BrN2 O2 S)

Compound Name

3-bromo-N-({2-[(2,3-dimethylphenoxy)methyl]-1,3-thiazol-4-yl}methyl)-N-ethylbenzamide

IUPAC name

3-bromo-N-({2-[(23-dimethylphenoxy)methyl]-13-thiazol-4-yl}methyl)-N-ethylbenzamide

SMILES

CCN(Cc1csc(COc2c(C)c(C)ccc2)n1)C(c1cccc(Br)c1)=O

InChI

InChI=1S/C22H23BrN2O2S/c1-4-25(22(26)17-8-6-9-18(23)11-17)12-19-14-28-21(24-19)13-27-20-10-5-7-15(2)16(20)3/h5-11,14H,4,12-13H2,1-3H3

InChI Key

QJXHVTAMXYKQIN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19863984

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.672

Distribution Coefficient, logD

5.672

Water Solubility, LogSw

-5.47

Polar Surface Area

34.484

Acid Dissociation Constant (pKa)

28.43

Base Dissociation Constant (pKb)

-1.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with V016-3183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-3183?
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What is the minimum amount of V016-3183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-3183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-3183
  • 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 V016-3183 available by request