V022-0691 Screening compound: 3-methoxy-N-(2-methoxyethyl)-N-[2-oxo-2-(4-{[4-(propan-2-yl)phenoxy]methyl}-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl)ethyl]benzamide

V022-0691 Screening compound: 3-methoxy-N-(2-methoxyethyl)-N-[2-oxo-2-(4-{[4-(propan-2-yl)phenoxy]methyl}-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl)ethyl]benzamide
V022-0691 Screening compound: 3-methoxy-N-(2-methoxyethyl)-N-[2-oxo-2-(4-{[4-(propan-2-yl)phenoxy]methyl}-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-0691
3-methoxy-N-(2-methoxyethyl)-N-[2-oxo-2-(4-{[4-(propan-2-yl)phenoxy]methyl}-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl)ethyl]benzamide

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

V022-0691

Molecular Formula

C30H36N2O5S (C30 H36 N2 O5 S)

Compound Name

3-methoxy-N-(2-methoxyethyl)-N-[2-oxo-2-(4-{[4-(propan-2-yl)phenoxy]methyl}-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl)ethyl]benzamide

IUPAC name

3-methoxy-N-(2-methoxyethyl)-N-[2-oxo-2-(4-{[4-(propan-2-yl)phenoxy]methyl}-4H5H6H7H-thieno[32-c]pyridin-5-yl)ethyl]benzamide

SMILES

CC(C)c(cc1)ccc1OCC(c1c(CC2)scc1)N2C(CN(CCOC)C(c1cc(OC)ccc1)=O)=O

InChI

InChI=1S/C30H36N2O5S/c1-21(2)22-8-10-24(11-9-22)37-20-27-26-13-17-38-28(26)12-14-32(27)29(33)19-31(15-16-35-3)30(34)23-6-5-7-25(18-23)36-4/h5-11,13,17-18,21,27H,12,14-16,19-20H2,1-4H3/t27-/m0/s1

InChI Key

FXCRUNLDQGNLJV-MHZLTWQESA-N

MDL Number (MFCD)

MFCD19865361

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

536.69

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.192

Distribution Coefficient, logD

5.192

Water Solubility, LogSw

-5.13

Polar Surface Area

56.151

Acid Dissociation Constant (pKa)

22.78

Base Dissociation Constant (pKb)

2.87

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with V022-0691 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of V022-0691 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-0691
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-0691
  • 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 V022-0691 available by request