V003-5106 Screening compound: 3-chloro-N-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-cyclopentylbenzamide

V003-5106 Screening compound: 3-chloro-N-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-cyclopentylbenzamide
V003-5106 Screening compound: 3-chloro-N-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-cyclopentylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-5106
3-chloro-N-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-cyclopentylbenzamide

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

V003-5106

Molecular Formula

C20H18Cl2N2O2 (C20 H18 Cl2 N2 O2)

Compound Name

3-chloro-N-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-cyclopentylbenzamide

IUPAC name

3-chloro-N-[(5-chloro-13-benzoxazol-2-yl)methyl]-N-cyclopentylbenzamide

SMILES

O=C(c1cccc(Cl)c1)N(Cc1nc(cc(cc2)Cl)c2o1)C1CCCC1

InChI

InChI=1S/C20H18Cl2N2O2/c21-14-5-3-4-13(10-14)20(25)24(16-6-1-2-7-16)12-19-23-17-11-15(22)8-9-18(17)26-19/h3-5,8-11,16H,1-2,6-7,12H2

InChI Key

PEAJCESJTLGPCZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19963060

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.28

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.498

Distribution Coefficient, logD

5.498

Water Solubility, LogSw

-5.96

Polar Surface Area

32.536

Acid Dissociation Constant (pKa)

25.94

Base Dissociation Constant (pKb)

-3.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with V003-5106 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-5106?
Check Price and Availability of V003-5106, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V003-5106 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-5106
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-5106
  • 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 V003-5106 available by request