V024-6966 Screening compound: N-(2-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(propan-2-yl)-2H-1,3-benzodioxole-5-carboxamide

V024-6966 Screening compound: N-(2-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(propan-2-yl)-2H-1,3-benzodioxole-5-carboxamide
V024-6966 Screening compound: N-(2-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(propan-2-yl)-2H-1,3-benzodioxole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-6966
N-(2-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(propan-2-yl)-2H-1,3-benzodioxole-5-carboxamide

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

V024-6966

Molecular Formula

C28H30N2O5S (C28 H30 N2 O5 S)

Compound Name

N-(2-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(propan-2-yl)-2H-1,3-benzodioxole-5-carboxamide

IUPAC name

N-(2-{4-[(4-methylphenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)-N-(propan-2-yl)-2H-13-benzodioxole-5-carboxamide

SMILES

CC(C)N(CC(N(CC1)C(COc2ccc(C)cc2)c2c1scc2)=O)C(c(cc1)cc2c1OCO2)=O

InChI

InChI=1S/C28H30N2O5S/c1-18(2)30(28(32)20-6-9-24-25(14-20)35-17-34-24)15-27(31)29-12-10-26-22(11-13-36-26)23(29)16-33-21-7-4-19(3)5-8-21/h4-9,11,13-14,18,23H,10,12,15-17H2,1-3H3/t23-/m0/s1

InChI Key

HALACCJJPZXFPG-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19866347

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.202

Distribution Coefficient, logD

5.202

Water Solubility, LogSw

-5.04

Polar Surface Area

57.145

Acid Dissociation Constant (pKa)

22.83

Base Dissociation Constant (pKb)

0.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with V024-6966 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-6966?
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What is the minimum amount of V024-6966 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-6966
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-6966
  • 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 V024-6966 available by request