V004-9887 Screening compound: 1-(4-{[6-(3-ethoxyphenyl)-2-(3-nitrophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}piperazin-1-yl)-3-methylbutan-1-one

V004-9887 Screening compound: 1-(4-{[6-(3-ethoxyphenyl)-2-(3-nitrophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}piperazin-1-yl)-3-methylbutan-1-one
V004-9887 Screening compound: 1-(4-{[6-(3-ethoxyphenyl)-2-(3-nitrophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}piperazin-1-yl)-3-methylbutan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-9887
1-(4-{[6-(3-ethoxyphenyl)-2-(3-nitrophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}piperazin-1-yl)-3-methylbutan-1-one

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

V004-9887

Molecular Formula

C31H35N5O4 (C31 H35 N5 O4)

Compound Name

1-(4-{[6-(3-ethoxyphenyl)-2-(3-nitrophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}piperazin-1-yl)-3-methylbutan-1-one

IUPAC name

1-(4-{[6-(3-ethoxyphenyl)-2-(3-nitrophenyl)imidazo[12-a]pyridin-3-yl]methyl}piperazin-1-yl)-3-methylbutan-1-one

SMILES

CCOc1cccc(-c(cc2)cn3c2nc(-c2cccc([N+]([O-])=O)c2)c3CN(CC2)CCN2C(CC(C)C)=O)c1

InChI

InChI=1S/C31H35N5O4/c1-4-40-27-10-6-7-23(19-27)25-11-12-29-32-31(24-8-5-9-26(18-24)36(38)39)28(35(29)20-25)21-33-13-15-34(16-14-33)30(37)17-22(2)3/h5-12,18-20,22H,4,13-17,21H2,1-3H3

InChI Key

VCMDXASYHBVXTO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20495413

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

541.65

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.666

Distribution Coefficient, logD

5.666

Water Solubility, LogSw

-5.32

Polar Surface Area

68.664

Acid Dissociation Constant (pKa)

24.81

Base Dissociation Constant (pKb)

4.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.50

References: we are preparing a list of scientific research reports with V004-9887 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-9887?
Check Price and Availability of V004-9887, 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 V004-9887 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-9887
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-9887
  • 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 V004-9887 available by request