C148-0470 Screening compound: 2-[1-(3-chlorophenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide

C148-0470 Screening compound: 2-[1-(3-chlorophenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide
C148-0470 Screening compound: 2-[1-(3-chlorophenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C148-0470
2-[1-(3-chlorophenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-propoxyphenyl)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

C148-0470

Molecular Formula

C27H34ClN5O3S (C27 H34 ClN5 O3 S)

Compound Name

2-[1-(3-chlorophenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide

IUPAC name

2-[1-(3-chlorophenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide

SMILES

CCCOc(cc1)ccc1NC(CC(C(N1c2cccc(Cl)c2)=O)N(CCN2CCN(C)CC2)C1=S)=O

InChI

InChI=1S/C27H34ClN5O3S/c1-3-17-36-23-9-7-21(8-10-23)29-25(34)19-24-26(35)33(22-6-4-5-20(28)18-22)27(37)32(24)16-15-31-13-11-30(2)12-14-31/h4-10,18,24H,3,11-17,19H2,1-2H3,(H,29,34)/t24-/m1/s1

InChI Key

VXGJLZPFYNHRFW-XMMPIXPASA-N

MDL Number (MFCD)

MFCD14722547

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

544.12

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.308

Distribution Coefficient, logD

2.064

Water Solubility, LogSw

-3.61

Polar Surface Area

56.252

Acid Dissociation Constant (pKa)

11.86

Base Dissociation Constant (pKb)

8.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.40

C148-0470 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 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 C148-0470 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C148-0470?
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What is the minimum amount of C148-0470 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C148-0470
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C148-0470
  • 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 C148-0470 available by request