V008-1845 Screening compound: [3-(benzyloxy)-2-hydroxypropyl][(3,4-dimethoxyphenyl)methyl](3-methylbutyl)amine

V008-1845 Screening compound: [3-(benzyloxy)-2-hydroxypropyl][(3,4-dimethoxyphenyl)methyl](3-methylbutyl)amine
V008-1845 Screening compound: [3-(benzyloxy)-2-hydroxypropyl][(3,4-dimethoxyphenyl)methyl](3-methylbutyl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-1845
[3-(benzyloxy)-2-hydroxypropyl][(3,4-dimethoxyphenyl)methyl](3-methylbutyl)amine

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

V008-1845

Molecular Formula

C24H35NO4 (C24 H35 NO4)

Compound Name

[3-(benzyloxy)-2-hydroxypropyl][(3,4-dimethoxyphenyl)methyl](3-methylbutyl)amine

IUPAC name

[3-(benzyloxy)-2-hydroxypropyl][(34-dimethoxyphenyl)methyl](3-methylbutyl)amine

SMILES

CC(C)CCN(CC(COCc1ccccc1)O)Cc(cc1)cc(OC)c1OC

InChI

InChI=1S/C24H35NO4/c1-19(2)12-13-25(15-21-10-11-23(27-3)24(14-21)28-4)16-22(26)18-29-17-20-8-6-5-7-9-20/h5-11,14,19,22,26H,12-13,15-18H2,1-4H3/t22-/m0/s1

InChI Key

TWRUNRIDYLVZSQ-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19839153

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

401.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.107

Distribution Coefficient, logD

2.616

Water Solubility, LogSw

-4.20

Polar Surface Area

44.243

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

8.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

V008-1845 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V008-1845 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-1845?
Check Price and Availability of V008-1845, 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 V008-1845 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-1845
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-1845
  • 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 V008-1845 available by request