V019-1395 Screening compound: 2-[(2-hydroxypropyl)[(oxolan-2-yl)methyl]amino]-1-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}ethan-1-one

V019-1395 Screening compound: 2-[(2-hydroxypropyl)[(oxolan-2-yl)methyl]amino]-1-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}ethan-1-one
V019-1395 Screening compound: 2-[(2-hydroxypropyl)[(oxolan-2-yl)methyl]amino]-1-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-1395
2-[(2-hydroxypropyl)[(oxolan-2-yl)methyl]amino]-1-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}ethan-1-one

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

V019-1395

Molecular Formula

C25H34N2O4S (C25 H34 N2 O4 S)

Compound Name

2-[(2-hydroxypropyl)[(oxolan-2-yl)methyl]amino]-1-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}ethan-1-one

IUPAC name

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

SMILES

CC(CN(CC1OCCC1)CC(N(CC1)C(COc2ccc(C)cc2)c2c1scc2)=O)O

InChI

InChI=1S/C25H34N2O4S/c1-18-5-7-20(8-6-18)31-17-23-22-10-13-32-24(22)9-11-27(23)25(29)16-26(14-19(2)28)15-21-4-3-12-30-21/h5-8,10,13,19,21,23,28H,3-4,9,11-12,14-17H2,1-2H3

InChI Key

UTDQVGLFABLILA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19882321

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

458.62

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.176

Distribution Coefficient, logD

3.176

Water Solubility, LogSw

-3.11

Polar Surface Area

52.919

Acid Dissociation Constant (pKa)

16.21

Base Dissociation Constant (pKb)

4.22

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

56.00

V019-1395 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V019-1395 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-1395?
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What is the minimum amount of V019-1395 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-1395
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-1395
  • 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 V019-1395 available by request