V028-6486 Screening compound: ethyl 4-[4-[4-(aminocarbonyl)piperidino]-3-(morpholinosulfonyl)anilino]-4-oxobutanoate

V028-6486 Screening compound: ethyl 4-[4-[4-(aminocarbonyl)piperidino]-3-(morpholinosulfonyl)anilino]-4-oxobutanoate
V028-6486 Screening compound: ethyl 4-[4-[4-(aminocarbonyl)piperidino]-3-(morpholinosulfonyl)anilino]-4-oxobutanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-6486
ethyl 4-[4-[4-(aminocarbonyl)piperidino]-3-(morpholinosulfonyl)anilino]-4-oxobutanoate

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

V028-6486

Molecular Formula

C22H32N4O7S (C22 H32 N4 O7 S)

Compound Name

ethyl 4-[4-[4-(aminocarbonyl)piperidino]-3-(morpholinosulfonyl)anilino]-4-oxobutanoate

IUPAC name

ethyl 3-{[4-(4-carbamoylpiperidin-1-yl)-3-(morpholine-4-sulfonyl)phenyl]carbamoyl}propanoate

SMILES

CCOC(CCC(Nc(cc1)cc(S(N2CCOCC2)(=O)=O)c1N(CC1)CCC1C(N)=O)=O)=O

InChI

InChI=1S/C22H32N4O7S/c1-2-33-21(28)6-5-20(27)24-17-3-4-18(25-9-7-16(8-10-25)22(23)29)19(15-17)34(30,31)26-11-13-32-14-12-26/h3-4,15-16H,2,5-14H2,1H3,(H2,23,29)(H,24,27)

InChI Key

NZWQTJKXYOATPV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19972740

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

496.58

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.460

Distribution Coefficient, logD

0.460

Water Solubility, LogSw

-2.46

Polar Surface Area

120.376

Acid Dissociation Constant (pKa)

10.42

Base Dissociation Constant (pKb)

3.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

59.09

V028-6486 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V028-6486 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-6486?
Check Price and Availability of V028-6486, 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 V028-6486 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-6486
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-6486
  • 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 V028-6486 available by request