C795-0082 Screening compound: 1-(2-chlorophenyl)-3-[5-(2,6-dimethylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]urea

C795-0082 Screening compound: 1-(2-chlorophenyl)-3-[5-(2,6-dimethylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]urea
C795-0082 Screening compound: 1-(2-chlorophenyl)-3-[5-(2,6-dimethylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound C795-0082
1-(2-chlorophenyl)-3-[5-(2,6-dimethylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]urea

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

C795-0082

Molecular Formula

C16H20ClN5OS (C16 H20 ClN5 OS)

Compound Name

1-(2-chlorophenyl)-3-[5-(2,6-dimethylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]urea

IUPAC name

1-(2-chlorophenyl)-3-[5-(26-dimethylpiperidin-1-yl)-134-thiadiazol-2-yl]urea

SMILES

CC(CCCC1C)N1c1nnc(NC(Nc(cccc2)c2Cl)=O)s1

InChI

InChI=1S/C16H20ClN5OS/c1-10-6-5-7-11(2)22(10)16-21-20-15(24-16)19-14(23)18-13-9-4-3-8-12(13)17/h3-4,8-11H,5-7H2,1-2H3,(H2,18,19,20,23)

InChI Key

CHUVTBONIPNTQM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14796712

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.89

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.243

Distribution Coefficient, logD

4.243

Water Solubility, LogSw

-4.28

Polar Surface Area

56.880

Acid Dissociation Constant (pKa)

10.56

Base Dissociation Constant (pKb)

1.90

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

43.80

C795-0082 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with C795-0082 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C795-0082?
Check Price and Availability of C795-0082, 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 C795-0082 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C795-0082
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C795-0082
  • 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 C795-0082 available by request