C436-1697 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-1-[(1,3,5-trimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-4-carboxamide

C436-1697 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-1-[(1,3,5-trimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-4-carboxamide
C436-1697 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-1-[(1,3,5-trimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C436-1697
N-[2-(3,4-diethoxyphenyl)ethyl]-1-[(1,3,5-trimethyl-1H-pyrazol-4-yl)sulfonyl]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

C436-1697

Molecular Formula

C24H36N4O5S (C24 H36 N4 O5 S)

Compound Name

N-[2-(3,4-diethoxyphenyl)ethyl]-1-[(1,3,5-trimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-4-carboxamide

IUPAC name

N-[2-(34-diethoxyphenyl)ethyl]-1-[(135-trimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-4-carboxamide

SMILES

CCOc(ccc(CCNC(C(CC1)CCN1S(c1c(C)n(C)nc1C)(=O)=O)=O)c1)c1OCC

InChI

InChI=1S/C24H36N4O5S/c1-6-32-21-9-8-19(16-22(21)33-7-2)10-13-25-24(29)20-11-14-28(15-12-20)34(30,31)23-17(3)26-27(5)18(23)4/h8-9,16,20H,6-7,10-15H2,1-5H3,(H,25,29)

InChI Key

FIEFLVOHGVSVLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14757863

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.64

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.727

Distribution Coefficient, logD

0.727

Water Solubility, LogSw

-2.47

Polar Surface Area

85.464

Acid Dissociation Constant (pKa)

13.94

Base Dissociation Constant (pKb)

0.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.30

References: we are preparing a list of scientific research reports with C436-1697 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C436-1697?
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What is the minimum amount of C436-1697 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C436-1697
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C436-1697
  • 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 C436-1697 available by request