Y501-7855 Screening compound: N-[3-chloro-4-(difluoromethoxy)phenyl]-N'-(2,3-dimethylphenyl)thiourea

Y501-7855 Screening compound: N-[3-chloro-4-(difluoromethoxy)phenyl]-N'-(2,3-dimethylphenyl)thiourea

Chemical Structure Depiction of ChemDiv screening compound Y501-7855
N-[3-chloro-4-(difluoromethoxy)phenyl]-N'-(2,3-dimethylphenyl)thiourea

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

Y501-7855

Molecular Formula

C16H15ClF2N2OS (C16 H15 ClF2 N2 OS)

Compound Name

N-[3-chloro-4-(difluoromethoxy)phenyl]-N'-(2,3-dimethylphenyl)thiourea

IUPAC name

1-[3-chloro-4-(difluoromethoxy)phenyl]-3-(23-dimethylphenyl)thiourea

SMILES

Cc1cccc(NC(Nc(cc2)cc(Cl)c2OC(F)F)=S)c1C

InChI

InChI=1S/C16H15ClF2N2OS/c1-9-4-3-5-13(10(9)2)21-16(23)20-11-6-7-14(12(17)8-11)22-15(18)19/h3-8,15H,1-2H3,(H2,20,21,23)

InChI Key

SQABVTZFRMMFJF-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.82

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.577

Distribution Coefficient, logD

5.577

Water Solubility, LogSw

-6.08

Polar Surface Area

25.055

Acid Dissociation Constant (pKa)

12.65

Base Dissociation Constant (pKb)

-1.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.75

References: we are preparing a list of scientific research reports with Y501-7855 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y501-7855?
Check Price and Availability of Y501-7855, 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 Y501-7855 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y501-7855
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y501-7855
  • 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 Y501-7855 available by request