C148-0544 Screening compound: N-(4-bromophenyl)-2-[1-(4-ethoxyphenyl)-3-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide

C148-0544 Screening compound: N-(4-bromophenyl)-2-[1-(4-ethoxyphenyl)-3-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide
C148-0544 Screening compound: N-(4-bromophenyl)-2-[1-(4-ethoxyphenyl)-3-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C148-0544
N-(4-bromophenyl)-2-[1-(4-ethoxyphenyl)-3-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide

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

C148-0544

Molecular Formula

C28H36BrN5O3S (C28 H36 BrN5 O3 S)

Compound Name

N-(4-bromophenyl)-2-[1-(4-ethoxyphenyl)-3-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide

IUPAC name

N-(4-bromophenyl)-2-[1-(4-ethoxyphenyl)-3-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide

SMILES

CCN1CCN(CCCN(C(CC(Nc(cc2)ccc2Br)=O)C(N2c(cc3)ccc3OCC)=O)C2=S)CC1

InChI

InChI=1S/C28H36BrN5O3S/c1-3-31-16-18-32(19-17-31)14-5-15-33-25(20-26(35)30-22-8-6-21(29)7-9-22)27(36)34(28(33)38)23-10-12-24(13-11-23)37-4-2/h6-13,25H,3-5,14-20H2,1-2H3,(H,30,35)/t25-/m0/s1

InChI Key

KZIXVHHSHJOLSZ-VWLOTQADSA-N

MDL Number (MFCD)

MFCD14722613

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

602.6

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.393

Distribution Coefficient, logD

2.445

Water Solubility, LogSw

-3.62

Polar Surface Area

56.018

Acid Dissociation Constant (pKa)

10.39

Base Dissociation Constant (pKb)

8.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.40

C148-0544 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with C148-0544 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C148-0544?
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What is the minimum amount of C148-0544 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C148-0544
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C148-0544
  • 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 C148-0544 available by request