C609-0198 Screening compound: 3-methyl-N-[1-(4-phenylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]butanamide

C609-0198 Screening compound: 3-methyl-N-[1-(4-phenylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]butanamide
C609-0198 Screening compound: 3-methyl-N-[1-(4-phenylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C609-0198
3-methyl-N-[1-(4-phenylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]butanamide

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

C609-0198

Molecular Formula

C22H31N3OS (C22 H31 N3 OS)

Compound Name

3-methyl-N-[1-(4-phenylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]butanamide

IUPAC name

3-methyl-N-[1-(4-phenylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]butanamide

SMILES

CC(C)CC(NC(C)C(c1cccs1)N(CC1)CCN1c1ccccc1)=O

InChI

InChI=1S/C22H31N3OS/c1-17(2)16-21(26)23-18(3)22(20-10-7-15-27-20)25-13-11-24(12-14-25)19-8-5-4-6-9-19/h4-10,15,17-18,22H,11-14,16H2,1-3H3,(H,23,26)

InChI Key

BXPMDIFPVNZUSJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04470805

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.57

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.226

Distribution Coefficient, logD

4.219

Water Solubility, LogSw

-4.01

Polar Surface Area

31.177

Acid Dissociation Constant (pKa)

13.22

Base Dissociation Constant (pKb)

5.62

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

50.00

C609-0198 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C609-0198 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C609-0198?
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What is the minimum amount of C609-0198 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C609-0198
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C609-0198
  • 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 C609-0198 available by request