V017-7723 Screening compound: (E)-N~1~-(6-{4-[3-(diethylamino)-2-hydroxypropyl]piperazino}-3-pyridyl)-3-phenyl-2-propenamide

V017-7723 Screening compound: (E)-N~1~-(6-{4-[3-(diethylamino)-2-hydroxypropyl]piperazino}-3-pyridyl)-3-phenyl-2-propenamide
V017-7723 Screening compound: (E)-N~1~-(6-{4-[3-(diethylamino)-2-hydroxypropyl]piperazino}-3-pyridyl)-3-phenyl-2-propenamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-7723
(E)-N~1~-(6-{4-[3-(diethylamino)-2-hydroxypropyl]piperazino}-3-pyridyl)-3-phenyl-2-propenamide

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

V017-7723

Molecular Formula

C25H35N5O2 (C25 H35 N5 O2)

Compound Name

(E)-N~1~-(6-{4-[3-(diethylamino)-2-hydroxypropyl]piperazino}-3-pyridyl)-3-phenyl-2-propenamide

IUPAC name

(2E)-N-(6-{4-[3-(diethylamino)-2-hydroxypropyl]piperazin-1-yl}pyridin-3-yl)-3-phenylprop-2-enamide

SMILES

CCN(CC)CC(CN(CC1)CCN1c(cc1)ncc1NC(/C=C/c1ccccc1)=O)O

InChI

InChI=1S/C25H35N5O2/c1-3-28(4-2)19-23(31)20-29-14-16-30(17-15-29)24-12-11-22(18-26-24)27-25(32)13-10-21-8-6-5-7-9-21/h5-13,18,23,31H,3-4,14-17,19-20H2,1-2H3,(H,27,32)/t23-/m0/s1

InChI Key

OVCLRTJVIBIKQS-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19898901

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

437.59

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.377

Distribution Coefficient, logD

2.411

Water Solubility, LogSw

-3.16

Polar Surface Area

59.034

Acid Dissociation Constant (pKa)

12.08

Base Dissociation Constant (pKb)

8.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.00

V017-7723 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V017-7723 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-7723?
Check Price and Availability of V017-7723, 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 V017-7723 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-7723
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-7723
  • 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 V017-7723 available by request