V022-2799 Screening compound: N-tert-butyl-2-chloro-N-(2-{4-[(2-methoxyphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)benzamide

V022-2799 Screening compound: N-tert-butyl-2-chloro-N-(2-{4-[(2-methoxyphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)benzamide
V022-2799 Screening compound: N-tert-butyl-2-chloro-N-(2-{4-[(2-methoxyphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-2799
N-tert-butyl-2-chloro-N-(2-{4-[(2-methoxyphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)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

V022-2799

Molecular Formula

C28H31ClN2O4S (C28 H31 ClN2 O4 S)

Compound Name

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

IUPAC name

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

SMILES

CC(C)(C)N(CC(N(CC1)C(COc(cccc2)c2OC)c2c1scc2)=O)C(c(cccc1)c1Cl)=O

InChI

InChI=1S/C28H31ClN2O4S/c1-28(2,3)31(27(33)19-9-5-6-10-21(19)29)17-26(32)30-15-13-25-20(14-16-36-25)22(30)18-35-24-12-8-7-11-23(24)34-4/h5-12,14,16,22H,13,15,17-18H2,1-4H3/t22-/m0/s1

InChI Key

YXEDVWRWACRILI-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19865890

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

527.08

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

5.388

Distribution Coefficient, logD

5.388

Water Solubility, LogSw

-5.76

Polar Surface Area

48.110

Acid Dissociation Constant (pKa)

22.64

Base Dissociation Constant (pKb)

0.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with V022-2799 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-2799?
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What is the minimum amount of V022-2799 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-2799
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-2799
  • 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 V022-2799 available by request