V014-2657 Screening compound: N,N-diethyl-2-{[(4-methoxy-3-methylphenyl)methyl]sulfanyl}-1-(propan-2-yl)-1H-1,3-benzodiazole-5-sulfonamide

V014-2657 Screening compound: N,N-diethyl-2-{[(4-methoxy-3-methylphenyl)methyl]sulfanyl}-1-(propan-2-yl)-1H-1,3-benzodiazole-5-sulfonamide
V014-2657 Screening compound: N,N-diethyl-2-{[(4-methoxy-3-methylphenyl)methyl]sulfanyl}-1-(propan-2-yl)-1H-1,3-benzodiazole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-2657
N,N-diethyl-2-{[(4-methoxy-3-methylphenyl)methyl]sulfanyl}-1-(propan-2-yl)-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

V014-2657

Molecular Formula

C23H31N3O3S2 (C23 H31 N3 O3 S2)

Compound Name

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

IUPAC name

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

SMILES

CCN(CC)S(c(cc1)cc2c1n(C(C)C)c(SCc(cc1)cc(C)c1OC)n2)(=O)=O

InChI

InChI=1S/C23H31N3O3S2/c1-7-25(8-2)31(27,28)19-10-11-21-20(14-19)24-23(26(21)16(3)4)30-15-18-9-12-22(29-6)17(5)13-18/h9-14,16H,7-8,15H2,1-6H3

InChI Key

SDRXJKPPUMZZGO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19960323

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

461.65

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

5.289

Distribution Coefficient, logD

5.288

Water Solubility, LogSw

-5.45

Polar Surface Area

50.551

Acid Dissociation Constant (pKa)

22.13

Base Dissociation Constant (pKb)

4.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

References: we are preparing a list of scientific research reports with V014-2657 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-2657?
Check Price and Availability of V014-2657, 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 V014-2657 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-2657
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-2657
  • 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 V014-2657 available by request