V013-5030 Screening compound: ethyl 4-({4-[5-(2-ethoxybenzamido)pyridin-2-yl]piperazine-1-carbonyl}amino)butanoate

V013-5030 Screening compound: ethyl 4-({4-[5-(2-ethoxybenzamido)pyridin-2-yl]piperazine-1-carbonyl}amino)butanoate
V013-5030 Screening compound: ethyl 4-({4-[5-(2-ethoxybenzamido)pyridin-2-yl]piperazine-1-carbonyl}amino)butanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-5030
ethyl 4-({4-[5-(2-ethoxybenzamido)pyridin-2-yl]piperazine-1-carbonyl}amino)butanoate

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

V013-5030

Molecular Formula

C25H33N5O5 (C25 H33 N5 O5)

Compound Name

ethyl 4-({4-[5-(2-ethoxybenzamido)pyridin-2-yl]piperazine-1-carbonyl}amino)butanoate

IUPAC name

ethyl 4-({4-[5-(2-ethoxybenzamido)pyridin-2-yl]piperazine-1-carbonyl}amino)butanoate

SMILES

CCOC(CCCNC(N(CC1)CCN1c(cc1)ncc1NC(c(cccc1)c1OCC)=O)=O)=O

InChI

InChI=1S/C25H33N5O5/c1-3-34-21-9-6-5-8-20(21)24(32)28-19-11-12-22(27-18-19)29-14-16-30(17-15-29)25(33)26-13-7-10-23(31)35-4-2/h5-6,8-9,11-12,18H,3-4,7,10,13-17H2,1-2H3,(H,26,33)(H,28,32)

InChI Key

PVBZCCXZTPCOED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19946454

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

483.57

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.381

Distribution Coefficient, logD

3.375

Water Solubility, LogSw

-3.64

Polar Surface Area

89.464

Acid Dissociation Constant (pKa)

9.34

Base Dissociation Constant (pKb)

4.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

References: we are preparing a list of scientific research reports with V013-5030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-5030?
Check Price and Availability of V013-5030, 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 V013-5030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-5030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-5030
  • 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 V013-5030 available by request