C224-1495 Screening compound: 2-methyl-1-(3-methylphenyl)-4-[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]piperazine

C224-1495 Screening compound: 2-methyl-1-(3-methylphenyl)-4-[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]piperazine
C224-1495 Screening compound: 2-methyl-1-(3-methylphenyl)-4-[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C224-1495
2-methyl-1-(3-methylphenyl)-4-[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]piperazine

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

C224-1495

Molecular Formula

C22H29N3O3S2 (C22 H29 N3 O3 S2)

Compound Name

2-methyl-1-(3-methylphenyl)-4-[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]piperazine

IUPAC name

2-methyl-1-(3-methylphenyl)-4-[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]piperazine

SMILES

CC(CN(CC1)C(C(CC2)CCN2S(c2cccs2)(=O)=O)=O)N1c1cc(C)ccc1

InChI

InChI=1S/C22H29N3O3S2/c1-17-5-3-6-20(15-17)25-13-12-23(16-18(25)2)22(26)19-8-10-24(11-9-19)30(27,28)21-7-4-14-29-21/h3-7,14-15,18-19H,8-13,16H2,1-2H3/t18-/m0/s1

InChI Key

IJOXFIKMESDLDJ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD14732652

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.450

Distribution Coefficient, logD

3.450

Water Solubility, LogSw

-3.54

Polar Surface Area

52.095

Acid Dissociation Constant (pKa)

23.63

Base Dissociation Constant (pKb)

7.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

C224-1495 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C224-1495 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C224-1495?
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What is the minimum amount of C224-1495 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C224-1495
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C224-1495
  • 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 C224-1495 available by request