V031-1141 Screening compound: benzyl N-[1-(4-benzylpiperidin-1-yl)-1-oxo-6-propanamidohexan-2-yl]carbamate

V031-1141 Screening compound: benzyl N-[1-(4-benzylpiperidin-1-yl)-1-oxo-6-propanamidohexan-2-yl]carbamate
V031-1141 Screening compound: benzyl N-[1-(4-benzylpiperidin-1-yl)-1-oxo-6-propanamidohexan-2-yl]carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-1141
benzyl N-[1-(4-benzylpiperidin-1-yl)-1-oxo-6-propanamidohexan-2-yl]carbamate

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

V031-1141

Molecular Formula

C29H39N3O4 (C29 H39 N3 O4)

Compound Name

benzyl N-[1-(4-benzylpiperidin-1-yl)-1-oxo-6-propanamidohexan-2-yl]carbamate

IUPAC name

benzyl N-[1-(4-benzylpiperidin-1-yl)-1-oxo-6-propanamidohexan-2-yl]carbamate

SMILES

CCC(NCCCCC(C(N1CCC(Cc2ccccc2)CC1)=O)NC(OCc1ccccc1)=O)=O

InChI

InChI=1S/C29H39N3O4/c1-2-27(33)30-18-10-9-15-26(31-29(35)36-22-25-13-7-4-8-14-25)28(34)32-19-16-24(17-20-32)21-23-11-5-3-6-12-23/h3-8,11-14,24,26H,2,9-10,15-22H2,1H3,(H,30,33)(H,31,35)/t26-/m0/s1

InChI Key

INMLZSYSMPHSOY-SANMLTNESA-N

MDL Number (MFCD)

MFCD01392051

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

493.65

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.718

Distribution Coefficient, logD

4.718

Water Solubility, LogSw

-4.57

Polar Surface Area

73.700

Acid Dissociation Constant (pKa)

12.42

Base Dissociation Constant (pKb)

5.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.30

V031-1141 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with V031-1141 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-1141?
Check Price and Availability of V031-1141, 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 V031-1141 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-1141
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-1141
  • 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 V031-1141 available by request