V010-9518 Screening compound: 2-{[(4-ethoxyphenyl)methyl]sulfanyl}-N,N-diethyl-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole-5-sulfonamide

V010-9518 Screening compound: 2-{[(4-ethoxyphenyl)methyl]sulfanyl}-N,N-diethyl-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole-5-sulfonamide
V010-9518 Screening compound: 2-{[(4-ethoxyphenyl)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 V010-9518
2-{[(4-ethoxyphenyl)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

V010-9518

Molecular Formula

C25H33N3O4S2 (C25 H33 N3 O4 S2)

Compound Name

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

IUPAC name

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

SMILES

CCN(CC)S(c(cc1)cc2c1n(CC1OCCC1)c(SCc(cc1)ccc1OCC)n2)(=O)=O

InChI

InChI=1S/C25H33N3O4S2/c1-4-27(5-2)34(29,30)22-13-14-24-23(16-22)26-25(28(24)17-21-8-7-15-32-21)33-18-19-9-11-20(12-10-19)31-6-3/h9-14,16,21H,4-8,15,17-18H2,1-3H3/t21-/m1/s1

InChI Key

GCEYMKJRNUINLE-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD19980286

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

503.69

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.528

Distribution Coefficient, logD

4.528

Water Solubility, LogSw

-4.28

Polar Surface Area

57.352

Acid Dissociation Constant (pKa)

24.27

Base Dissociation Constant (pKb)

4.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.00

References: we are preparing a list of scientific research reports with V010-9518 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-9518?
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What is the minimum amount of V010-9518 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-9518
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-9518
  • 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 V010-9518 available by request