Y030-3770 Screening compound: 1-(4-fluorobenzenesulfonyl)-5,6-dimethyl-1H-1,3-benzodiazole

Y030-3770 Screening compound: 1-(4-fluorobenzenesulfonyl)-5,6-dimethyl-1H-1,3-benzodiazole
Y030-3770 Screening compound: 1-(4-fluorobenzenesulfonyl)-5,6-dimethyl-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-3770
1-(4-fluorobenzenesulfonyl)-5,6-dimethyl-1H-1,3-benzodiazole

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

Y030-3770

Molecular Formula

C15H13FN2O2S (C15 H13 FN2 O2 S)

Compound Name

1-(4-fluorobenzenesulfonyl)-5,6-dimethyl-1H-1,3-benzodiazole

IUPAC name

1-(4-fluorobenzenesulfonyl)-56-dimethyl-1H-13-benzodiazole

SMILES

Cc(c(C)c1)cc2c1ncn2S(c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C15H13FN2O2S/c1-10-7-14-15(8-11(10)2)18(9-17-14)21(19,20)13-5-3-12(16)4-6-13/h3-9H,1-2H3

InChI Key

CZCPLLBAMJPPHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01819967

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.616

Distribution Coefficient, logD

3.616

Water Solubility, LogSw

-3.83

Polar Surface Area

37.684

Acid Dissociation Constant (pKa)

26.75

Base Dissociation Constant (pKb)

0.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

Y030-3770 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with Y030-3770 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-3770?
Check Price and Availability of Y030-3770, 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 Y030-3770 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-3770
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-3770
  • 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 Y030-3770 available by request