C609-0346 Screening compound: N-{1-[4-(4-fluorophenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}-3,4,5-trimethoxybenzamide

C609-0346 Screening compound: N-{1-[4-(4-fluorophenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}-3,4,5-trimethoxybenzamide
C609-0346 Screening compound: N-{1-[4-(4-fluorophenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}-3,4,5-trimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C609-0346
N-{1-[4-(4-fluorophenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}-3,4,5-trimethoxybenzamide

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

C609-0346

Molecular Formula

C27H32FN3O4S (C27 H32 FN3 O4 S)

Compound Name

N-{1-[4-(4-fluorophenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}-3,4,5-trimethoxybenzamide

IUPAC name

N-{1-[4-(4-fluorophenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}-345-trimethoxybenzamide

SMILES

CC(C(c1cccs1)N(CC1)CCN1c(cc1)ccc1F)NC(c(cc1OC)cc(OC)c1OC)=O

InChI

InChI=1S/C27H32FN3O4S/c1-18(29-27(32)19-16-22(33-2)26(35-4)23(17-19)34-3)25(24-6-5-15-36-24)31-13-11-30(12-14-31)21-9-7-20(28)8-10-21/h5-10,15-18,25H,11-14H2,1-4H3,(H,29,32)

InChI Key

JLAOUYFCAUSKLG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04470855

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

513.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.200

Distribution Coefficient, logD

4.199

Water Solubility, LogSw

-4.20

Polar Surface Area

54.097

Acid Dissociation Constant (pKa)

13.62

Base Dissociation Constant (pKb)

4.86

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

37.00

C609-0346 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 C609-0346 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C609-0346?
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What is the minimum amount of C609-0346 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C609-0346
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C609-0346
  • 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 C609-0346 available by request