V005-5728 Screening compound: N-cyclohexyl-3-nitro-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide

V005-5728 Screening compound: N-cyclohexyl-3-nitro-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide
V005-5728 Screening compound: N-cyclohexyl-3-nitro-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-5728
N-cyclohexyl-3-nitro-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide

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

V005-5728

Molecular Formula

C23H23N5O6 (C23 H23 N5 O6)

Compound Name

N-cyclohexyl-3-nitro-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide

IUPAC name

N-cyclohexyl-3-nitro-N-{2-[3-(4-nitrophenyl)-124-oxadiazol-5-yl]ethyl}benzamide

SMILES

[O-][N+](c(cc1)ccc1-c1noc(CCN(C2CCCCC2)C(c2cccc([N+]([O-])=O)c2)=O)n1)=O

InChI

InChI=1S/C23H23N5O6/c29-23(17-5-4-8-20(15-17)28(32)33)26(18-6-2-1-3-7-18)14-13-21-24-22(25-34-21)16-9-11-19(12-10-16)27(30)31/h4-5,8-12,15,18H,1-3,6-7,13-14H2

InChI Key

GRVUXUVMCLLFIJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19781196

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.47

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

5.458

Distribution Coefficient, logD

5.458

Water Solubility, LogSw

-5.80

Polar Surface Area

113.507

Acid Dissociation Constant (pKa)

26.97

Base Dissociation Constant (pKb)

-2.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

V005-5728 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with V005-5728 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-5728?
Check Price and Availability of V005-5728, 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 V005-5728 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-5728
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-5728
  • 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 V005-5728 available by request