C857-2224 Screening compound: 1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N~3~-methyl-3-piperidinecarboxamide

C857-2224 Screening compound: 1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N~3~-methyl-3-piperidinecarboxamide
C857-2224 Screening compound: 1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N~3~-methyl-3-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C857-2224
1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N~3~-methyl-3-piperidinecarboxamide

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

C857-2224

Molecular Formula

C15H21N5OS (C15 H21 N5 OS)

Compound Name

1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N~3~-methyl-3-piperidinecarboxamide

IUPAC name

1-[5-(25-dimethyl-1H-pyrrol-1-yl)-134-thiadiazol-2-yl]-N-methylpiperidine-3-carboxamide

SMILES

Cc1ccc(C)n1-c1nnc(N(CCC2)CC2C(NC)=O)s1

InChI

InChI=1S/C15H21N5OS/c1-10-6-7-11(2)20(10)15-18-17-14(22-15)19-8-4-5-12(9-19)13(21)16-3/h6-7,12H,4-5,8-9H2,1-3H3,(H,16,21)/t12-/m0/s1

InChI Key

LBQYXVBCLOUUIN-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD14801227

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.582

Distribution Coefficient, logD

1.582

Water Solubility, LogSw

-2.24

Polar Surface Area

54.482

Acid Dissociation Constant (pKa)

14.62

Base Dissociation Constant (pKb)

2.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.33

References: we are preparing a list of scientific research reports with C857-2224 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C857-2224?
Check Price and Availability of C857-2224, 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 C857-2224 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C857-2224
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C857-2224
  • 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 C857-2224 available by request