V010-6890 Screening compound: ethyl 2-(4-{5-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-yl)sulfonyl]-2-methoxyphenyl}piperazin-1-yl)-2-oxoacetate

V010-6890 Screening compound: ethyl 2-(4-{5-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-yl)sulfonyl]-2-methoxyphenyl}piperazin-1-yl)-2-oxoacetate
V010-6890 Screening compound: ethyl 2-(4-{5-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-yl)sulfonyl]-2-methoxyphenyl}piperazin-1-yl)-2-oxoacetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-6890
ethyl 2-(4-{5-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-yl)sulfonyl]-2-methoxyphenyl}piperazin-1-yl)-2-oxoacetate

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

V010-6890

Molecular Formula

C26H33N3O8S (C26 H33 N3 O8 S)

Compound Name

ethyl 2-(4-{5-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-yl)sulfonyl]-2-methoxyphenyl}piperazin-1-yl)-2-oxoacetate

IUPAC name

ethyl 2-(4-{5-[(67-dimethoxy-1234-tetrahydroisoquinolin-2-yl)sulfonyl]-2-methoxyphenyl}piperazin-1-yl)-2-oxoacetate

SMILES

CCOC(C(N(CC1)CCN1c(cc(cc1)S(N(CC2)Cc(cc3OC)c2cc3OC)(=O)=O)c1OC)=O)=O

InChI

InChI=1S/C26H33N3O8S/c1-5-37-26(31)25(30)28-12-10-27(11-13-28)21-16-20(6-7-22(21)34-2)38(32,33)29-9-8-18-14-23(35-3)24(36-4)15-19(18)17-29/h6-7,14-16H,5,8-13,17H2,1-4H3

InChI Key

ONMZRJYCKJGDBZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19950593

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

547.63

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.869

Distribution Coefficient, logD

2.869

Water Solubility, LogSw

-3.47

Polar Surface Area

95.135

Acid Dissociation Constant (pKa)

25.79

Base Dissociation Constant (pKb)

2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

V010-6890 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V010-6890 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-6890?
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What is the minimum amount of V010-6890 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-6890
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-6890
  • 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 V010-6890 available by request