V021-3694 Screening compound: 2-[cyclopropyl(2-hydroxypropyl)amino]-1-[4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-ethanone

V021-3694 Screening compound: 2-[cyclopropyl(2-hydroxypropyl)amino]-1-[4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-ethanone
V021-3694 Screening compound: 2-[cyclopropyl(2-hydroxypropyl)amino]-1-[4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-3694
2-[cyclopropyl(2-hydroxypropyl)amino]-1-[4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-ethanone

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

V021-3694

Molecular Formula

C24H32N2O3S (C24 H32 N2 O3 S)

Compound Name

2-[cyclopropyl(2-hydroxypropyl)amino]-1-[4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-ethanone

IUPAC name

2-[cyclopropyl(2-hydroxypropyl)amino]-1-{4-[(24-dimethylphenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}ethan-1-one

SMILES

CC(CN(CC(N(CC1)C(COc2c(C)cc(C)cc2)c2c1scc2)=O)C1CC1)O

InChI

InChI=1S/C24H32N2O3S/c1-16-4-7-22(17(2)12-16)29-15-21-20-9-11-30-23(20)8-10-26(21)24(28)14-25(13-18(3)27)19-5-6-19/h4,7,9,11-12,18-19,21,27H,5-6,8,10,13-15H2,1-3H3

InChI Key

PEBKOSGAWPWCHE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19882431

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

428.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.462

Distribution Coefficient, logD

4.462

Water Solubility, LogSw

-4.35

Polar Surface Area

43.819

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

4.66

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

54.17

V021-3694 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

Anti-HIV1 Library (19540 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 V021-3694 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-3694?
Check Price and Availability of V021-3694, 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 V021-3694 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-3694
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-3694
  • 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 V021-3694 available by request