V012-2742 Screening compound: N-tert-butyl-N-(2-{4-[(2-methoxyphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-methylpropanamide

V012-2742 Screening compound: N-tert-butyl-N-(2-{4-[(2-methoxyphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-methylpropanamide
V012-2742 Screening compound: N-tert-butyl-N-(2-{4-[(2-methoxyphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-methylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-2742
N-tert-butyl-N-(2-{4-[(2-methoxyphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-methylpropanamide

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

V012-2742

Molecular Formula

C25H34N2O4S (C25 H34 N2 O4 S)

Compound Name

N-tert-butyl-N-(2-{4-[(2-methoxyphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-methylpropanamide

IUPAC name

N-tert-butyl-N-(2-{4-[(2-methoxyphenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)-2-methylpropanamide

SMILES

CC(C)C(N(CC(N(CC1)C(COc(cccc2)c2OC)c2c1scc2)=O)C(C)(C)C)=O

InChI

InChI=1S/C25H34N2O4S/c1-17(2)24(29)27(25(3,4)5)15-23(28)26-13-11-22-18(12-14-32-22)19(26)16-31-21-10-8-7-9-20(21)30-6/h7-10,12,14,17,19H,11,13,15-16H2,1-6H3/t19-/m0/s1

InChI Key

QHOGXRPVSKPNLT-IBGZPJMESA-N

MDL Number (MFCD)

MFCD19865888

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.62

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.419

Distribution Coefficient, logD

4.419

Water Solubility, LogSw

-4.32

Polar Surface Area

48.382

Acid Dissociation Constant (pKa)

23.49

Base Dissociation Constant (pKb)

2.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.00

References: we are preparing a list of scientific research reports with V012-2742 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-2742?
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What is the minimum amount of V012-2742 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-2742
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-2742
  • 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 V012-2742 available by request