V022-6914 Screening compound: 1-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-[(2-hydroxyhex-5-en-1-yl)(3-methylbutyl)amino]ethan-1-one

V022-6914 Screening compound: 1-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-[(2-hydroxyhex-5-en-1-yl)(3-methylbutyl)amino]ethan-1-one
V022-6914 Screening compound: 1-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-[(2-hydroxyhex-5-en-1-yl)(3-methylbutyl)amino]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-6914
1-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-[(2-hydroxyhex-5-en-1-yl)(3-methylbutyl)amino]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

V022-6914

Molecular Formula

C29H42N2O3S (C29 H42 N2 O3 S)

Compound Name

1-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-[(2-hydroxyhex-5-en-1-yl)(3-methylbutyl)amino]ethan-1-one

IUPAC name

1-{4-[(24-dimethylphenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-[(2-hydroxyhex-5-en-1-yl)(3-methylbutyl)amino]ethan-1-one

SMILES

CC(C)CCN(CC(CCC=C)O)CC(N(CC1)C(COc2c(C)cc(C)cc2)c2c1scc2)=O

InChI

InChI=1S/C29H42N2O3S/c1-6-7-8-24(32)18-30(14-11-21(2)3)19-29(33)31-15-12-28-25(13-16-35-28)26(31)20-34-27-10-9-22(4)17-23(27)5/h6,9-10,13,16-17,21,24,26,32H,1,7-8,11-12,14-15,18-20H2,2-5H3

InChI Key

JYTXCUZKLRTOQR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19882645

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

498.73

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.685

Distribution Coefficient, logD

6.673

Water Solubility, LogSw

-5.56

Polar Surface Area

44.743

Acid Dissociation Constant (pKa)

16.82

Base Dissociation Constant (pKb)

5.85

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

55.20

References: we are preparing a list of scientific research reports with V022-6914 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of V022-6914 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-6914
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-6914
  • 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 V022-6914 available by request