V012-4311 Screening compound: ethyl 4-({4-[3-(2H-1,3-benzodioxole-5-amido)pyridin-2-yl]piperazine-1-carbonyl}amino)butanoate

V012-4311 Screening compound: ethyl 4-({4-[3-(2H-1,3-benzodioxole-5-amido)pyridin-2-yl]piperazine-1-carbonyl}amino)butanoate
V012-4311 Screening compound: ethyl 4-({4-[3-(2H-1,3-benzodioxole-5-amido)pyridin-2-yl]piperazine-1-carbonyl}amino)butanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-4311
ethyl 4-({4-[3-(2H-1,3-benzodioxole-5-amido)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

V012-4311

Molecular Formula

C24H29N5O6 (C24 H29 N5 O6)

Compound Name

ethyl 4-({4-[3-(2H-1,3-benzodioxole-5-amido)pyridin-2-yl]piperazine-1-carbonyl}amino)butanoate

IUPAC name

ethyl 4-({4-[3-(2H-13-benzodioxole-5-amido)pyridin-2-yl]piperazine-1-carbonyl}amino)butanoate

SMILES

CCOC(CCCNC(N(CC1)CCN1c1ncccc1NC(c(cc1)cc2c1OCO2)=O)=O)=O

InChI

InChI=1S/C24H29N5O6/c1-2-33-21(30)6-4-10-26-24(32)29-13-11-28(12-14-29)22-18(5-3-9-25-22)27-23(31)17-7-8-19-20(15-17)35-16-34-19/h3,5,7-9,15H,2,4,6,10-14,16H2,1H3,(H,26,32)(H,27,31)

InChI Key

INGUAVLZRBCZGG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19946438

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

483.52

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.499

Distribution Coefficient, logD

2.484

Water Solubility, LogSw

-2.89

Polar Surface Area

99.051

Acid Dissociation Constant (pKa)

8.85

Base Dissociation Constant (pKb)

4.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

References: we are preparing a list of scientific research reports with V012-4311 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-4311?
Check Price and Availability of V012-4311, 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 V012-4311 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-4311
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-4311
  • 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 V012-4311 available by request