V007-4069 Screening compound: N,N-diethyl-2-{[(3-fluoro-4-methylphenyl)methyl]sulfanyl}-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole-5-sulfonamide

V007-4069 Screening compound: N,N-diethyl-2-{[(3-fluoro-4-methylphenyl)methyl]sulfanyl}-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole-5-sulfonamide
V007-4069 Screening compound: N,N-diethyl-2-{[(3-fluoro-4-methylphenyl)methyl]sulfanyl}-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-4069
N,N-diethyl-2-{[(3-fluoro-4-methylphenyl)methyl]sulfanyl}-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

V007-4069

Molecular Formula

C24H30FN3O3S2 (C24 H30 FN3 O3 S2)

Compound Name

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

IUPAC name

NN-diethyl-2-{[(3-fluoro-4-methylphenyl)methyl]sulfanyl}-1-[(oxolan-2-yl)methyl]-1H-13-benzodiazole-5-sulfonamide

SMILES

CCN(CC)S(c(cc1)cc2c1n(CC1OCCC1)c(SCc1cc(F)c(C)cc1)n2)(=O)=O

InChI

InChI=1S/C24H30FN3O3S2/c1-4-27(5-2)33(29,30)20-10-11-23-22(14-20)26-24(28(23)15-19-7-6-12-31-19)32-16-18-9-8-17(3)21(25)13-18/h8-11,13-14,19H,4-7,12,15-16H2,1-3H3/t19-/m1/s1

InChI Key

OWDZAJPDOCPSQG-LJQANCHMSA-N

MDL Number (MFCD)

MFCD19960278

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

491.65

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.955

Distribution Coefficient, logD

4.955

Water Solubility, LogSw

-4.69

Polar Surface Area

50.228

Acid Dissociation Constant (pKa)

24.24

Base Dissociation Constant (pKb)

4.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.80

References: we are preparing a list of scientific research reports with V007-4069 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-4069?
Check Price and Availability of V007-4069, 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 V007-4069 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-4069
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-4069
  • 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 V007-4069 available by request