C857-1924 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide

C857-1924 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
C857-1924 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C857-1924
N-[2-(3,4-diethoxyphenyl)ethyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide

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

C857-1924

Molecular Formula

C26H35N5O3S (C26 H35 N5 O3 S)

Compound Name

N-[2-(3,4-diethoxyphenyl)ethyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide

IUPAC name

N-[2-(34-diethoxyphenyl)ethyl]-1-[5-(25-dimethyl-1H-pyrrol-1-yl)-134-thiadiazol-2-yl]piperidine-4-carboxamide

SMILES

CCOc(ccc(CCNC(C(CC1)CCN1c1nnc(-n2c(C)ccc2C)s1)=O)c1)c1OCC

InChI

InChI=1S/C26H35N5O3S/c1-5-33-22-10-9-20(17-23(22)34-6-2)11-14-27-24(32)21-12-15-30(16-13-21)25-28-29-26(35-25)31-18(3)7-8-19(31)4/h7-10,17,21H,5-6,11-16H2,1-4H3,(H,27,32)

InChI Key

ZNSNSQXXEGXPLA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14801136

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.66

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.231

Distribution Coefficient, logD

3.231

Water Solubility, LogSw

-3.21

Polar Surface Area

68.389

Acid Dissociation Constant (pKa)

13.94

Base Dissociation Constant (pKb)

2.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with C857-1924 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C857-1924?
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What is the minimum amount of C857-1924 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C857-1924
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C857-1924
  • 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 C857-1924 available by request