1535-0016 Screening compound: 2-[2-(ethylsulfanyl)-1H-1,3-benzodiazol-1-yl]ethan-1-ol

1535-0016 Screening compound: 2-[2-(ethylsulfanyl)-1H-1,3-benzodiazol-1-yl]ethan-1-ol
1535-0016 Screening compound: 2-[2-(ethylsulfanyl)-1H-1,3-benzodiazol-1-yl]ethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 1535-0016
2-[2-(ethylsulfanyl)-1H-1,3-benzodiazol-1-yl]ethan-1-ol

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

1535-0016

Molecular Formula

C11H14N2OS (C11 H14 N2 OS)

Compound Name

2-[2-(ethylsulfanyl)-1H-1,3-benzodiazol-1-yl]ethan-1-ol

IUPAC name

2-[2-(ethylsulfanyl)-1H-13-benzodiazol-1-yl]ethan-1-ol

SMILES

CCSc1nc(cccc2)c2n1CCO

InChI

InChI=1S/C11H14N2OS/c1-2-15-11-12-9-5-3-4-6-10(9)13(11)7-8-14/h3-6,14H,2,7-8H2,1H3

InChI Key

SDQJUCRPCMJJCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01079713

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

222.31

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.578

Distribution Coefficient, logD

2.576

Water Solubility, LogSw

-2.38

Polar Surface Area

27.654

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

5.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.36

References: we are preparing a list of scientific research reports with 1535-0016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1535-0016?
Check Price and Availability of 1535-0016, 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 1535-0016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1535-0016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1535-0016
  • 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 1535-0016 available by request