V003-2649 Screening compound: 2-{[(3,4-dimethoxypyridin-2-yl)methyl]sulfanyl}-N,N-diethyl-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole-5-sulfonamide

V003-2649 Screening compound: 2-{[(3,4-dimethoxypyridin-2-yl)methyl]sulfanyl}-N,N-diethyl-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole-5-sulfonamide
V003-2649 Screening compound: 2-{[(3,4-dimethoxypyridin-2-yl)methyl]sulfanyl}-N,N-diethyl-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-2649
2-{[(3,4-dimethoxypyridin-2-yl)methyl]sulfanyl}-N,N-diethyl-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole-5-sulfonamide

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

V003-2649

Molecular Formula

C24H32N4O5S2 (C24 H32 N4 O5 S2)

Compound Name

2-{[(3,4-dimethoxypyridin-2-yl)methyl]sulfanyl}-N,N-diethyl-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole-5-sulfonamide

IUPAC name

2-{[(34-dimethoxypyridin-2-yl)methyl]sulfanyl}-NN-diethyl-1-[(oxolan-2-yl)methyl]-1H-13-benzodiazole-5-sulfonamide

SMILES

CCN(CC)S(c(cc1)cc2c1n(CC1OCCC1)c(SCc1nccc(OC)c1OC)n2)(=O)=O

InChI

InChI=1S/C24H32N4O5S2/c1-5-27(6-2)35(29,30)18-9-10-21-19(14-18)26-24(28(21)15-17-8-7-13-33-17)34-16-20-23(32-4)22(31-3)11-12-25-20/h9-12,14,17H,5-8,13,15-16H2,1-4H3/t17-/m1/s1

InChI Key

UTTYNQQRVMUVBI-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD19960328

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

520.67

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.423

Distribution Coefficient, logD

3.417

Water Solubility, LogSw

-3.72

Polar Surface Area

75.889

Acid Dissociation Constant (pKa)

24.27

Base Dissociation Constant (pKb)

5.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

V003-2649 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V003-2649 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-2649?
Check Price and Availability of V003-2649, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V003-2649 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-2649
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-2649
  • 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 V003-2649 available by request