G354-0048 Screening compound: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(1H-pyrrol-1-yl)-3-(thiophen-2-yl)propan-1-one

G354-0048 Screening compound: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(1H-pyrrol-1-yl)-3-(thiophen-2-yl)propan-1-one
G354-0048 Screening compound: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(1H-pyrrol-1-yl)-3-(thiophen-2-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G354-0048
1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(1H-pyrrol-1-yl)-3-(thiophen-2-yl)propan-1-one

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

G354-0048

Molecular Formula

C22H25N3O2S (C22 H25 N3 O2 S)

Compound Name

1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(1H-pyrrol-1-yl)-3-(thiophen-2-yl)propan-1-one

IUPAC name

1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(1H-pyrrol-1-yl)-3-(thiophen-2-yl)propan-1-one

SMILES

COc(cccc1)c1N(CC1)CCN1C(CC(c1cccs1)n1cccc1)=O

InChI

InChI=1S/C22H25N3O2S/c1-27-20-8-3-2-7-18(20)24-12-14-25(15-13-24)22(26)17-19(21-9-6-16-28-21)23-10-4-5-11-23/h2-11,16,19H,12-15,17H2,1H3/t19-/m0/s1

InChI Key

BGRMCDDZVVRAJO-IBGZPJMESA-N

MDL Number (MFCD)

MFCD15000964

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.53

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.528

Distribution Coefficient, logD

3.528

Water Solubility, LogSw

-3.75

Polar Surface Area

31.490

Acid Dissociation Constant (pKa)

22.61

Base Dissociation Constant (pKb)

4.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

G354-0048 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G354-0048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G354-0048?
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What is the minimum amount of G354-0048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G354-0048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G354-0048
  • 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 G354-0048 available by request