8004-3713 Screening compound: 3-[2-(benzyloxy)ethyl]-1-[6-({[2-(benzyloxy)ethyl]carbamoyl}amino)hexyl]urea

8004-3713 Screening compound: 3-[2-(benzyloxy)ethyl]-1-[6-({[2-(benzyloxy)ethyl]carbamoyl}amino)hexyl]urea
8004-3713 Screening compound: 3-[2-(benzyloxy)ethyl]-1-[6-({[2-(benzyloxy)ethyl]carbamoyl}amino)hexyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-3713
3-[2-(benzyloxy)ethyl]-1-[6-({[2-(benzyloxy)ethyl]carbamoyl}amino)hexyl]urea

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

8004-3713

Molecular Formula

C26H38N4O4 (C26 H38 N4 O4)

Compound Name

3-[2-(benzyloxy)ethyl]-1-[6-({[2-(benzyloxy)ethyl]carbamoyl}amino)hexyl]urea

IUPAC name

3-[2-(benzyloxy)ethyl]-1-[6-({[2-(benzyloxy)ethyl]carbamoyl}amino)hexyl]urea

SMILES

O=C(NCCCCCCNC(NCCOCc1ccccc1)=O)NCCOCc1ccccc1

InChI

InChI=1S/C26H38N4O4/c31-25(29-17-19-33-21-23-11-5-3-6-12-23)27-15-9-1-2-10-16-28-26(32)30-18-20-34-22-24-13-7-4-8-14-24/h3-8,11-14H,1-2,9-10,15-22H2,(H2,27,29,31)(H2,28,30,32)

InChI Key

JTUSCAQFBINSDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00321475

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.61

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

21.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.534

Distribution Coefficient, logD

2.534

Water Solubility, LogSw

-2.71

Polar Surface Area

86.476

Acid Dissociation Constant (pKa)

15.75

Base Dissociation Constant (pKb)

1.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

8004-3713 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Lipid Metabolism Library (9174 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8004-3713 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-3713?
Check Price and Availability of 8004-3713, 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 8004-3713 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-3713
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-3713
  • 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 8004-3713 available by request