V005-5806 Screening compound: 2-({[5-(diethylsulfamoyl)-1-(propan-2-yl)-1H-1,3-benzodiazol-2-yl]sulfanyl}methyl)phenyl acetate

V005-5806 Screening compound: 2-({[5-(diethylsulfamoyl)-1-(propan-2-yl)-1H-1,3-benzodiazol-2-yl]sulfanyl}methyl)phenyl acetate
V005-5806 Screening compound: 2-({[5-(diethylsulfamoyl)-1-(propan-2-yl)-1H-1,3-benzodiazol-2-yl]sulfanyl}methyl)phenyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-5806
2-({[5-(diethylsulfamoyl)-1-(propan-2-yl)-1H-1,3-benzodiazol-2-yl]sulfanyl}methyl)phenyl acetate

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

V005-5806

Molecular Formula

C23H29N3O4S2 (C23 H29 N3 O4 S2)

Compound Name

2-({[5-(diethylsulfamoyl)-1-(propan-2-yl)-1H-1,3-benzodiazol-2-yl]sulfanyl}methyl)phenyl acetate

IUPAC name

2-({[5-(diethylsulfamoyl)-1-(propan-2-yl)-1H-13-benzodiazol-2-yl]sulfanyl}methyl)phenyl acetate

SMILES

CCN(CC)S(c(cc1)cc2c1n(C(C)C)c(SCc(cccc1)c1OC(C)=O)n2)(=O)=O

InChI

InChI=1S/C23H29N3O4S2/c1-6-25(7-2)32(28,29)19-12-13-21-20(14-19)24-23(26(21)16(3)4)31-15-18-10-8-9-11-22(18)30-17(5)27/h8-14,16H,6-7,15H2,1-5H3

InChI Key

UHGOQKHCQWHHRJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19960297

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

475.63

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.683

Distribution Coefficient, logD

4.682

Water Solubility, LogSw

-4.53

Polar Surface Area

63.759

Acid Dissociation Constant (pKa)

22.13

Base Dissociation Constant (pKb)

4.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

References: we are preparing a list of scientific research reports with V005-5806 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-5806?
Check Price and Availability of V005-5806, 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 V005-5806 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-5806
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-5806
  • 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 V005-5806 available by request