V017-8085 Screening compound: 2-[cyclopropyl(3-ethoxy-2-hydroxypropyl)amino]-1-{4-[(4-methoxyphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}ethan-1-one

V017-8085 Screening compound: 2-[cyclopropyl(3-ethoxy-2-hydroxypropyl)amino]-1-{4-[(4-methoxyphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}ethan-1-one
V017-8085 Screening compound: 2-[cyclopropyl(3-ethoxy-2-hydroxypropyl)amino]-1-{4-[(4-methoxyphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-8085
2-[cyclopropyl(3-ethoxy-2-hydroxypropyl)amino]-1-{4-[(4-methoxyphenoxy)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

V017-8085

Molecular Formula

C25H34N2O5S (C25 H34 N2 O5 S)

Compound Name

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

IUPAC name

2-[cyclopropyl(3-ethoxy-2-hydroxypropyl)amino]-1-{4-[(4-methoxyphenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}ethan-1-one

SMILES

CCOCC(CN(CC(N(CC1)C(COc(cc2)ccc2OC)c2c1scc2)=O)C1CC1)O

InChI

InChI=1S/C25H34N2O5S/c1-3-31-16-19(28)14-26(18-4-5-18)15-25(29)27-12-10-24-22(11-13-33-24)23(27)17-32-21-8-6-20(30-2)7-9-21/h6-9,11,13,18-19,23,28H,3-5,10,12,14-17H2,1-2H3

InChI Key

HCWZMNVDXAMSKE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19882628

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

474.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.338

Distribution Coefficient, logD

3.337

Water Solubility, LogSw

-3.20

Polar Surface Area

59.477

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

4.24

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

56.00

References: we are preparing a list of scientific research reports with V017-8085 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-8085?
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What is the minimum amount of V017-8085 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-8085
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-8085
  • 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 V017-8085 available by request