C906-0303 Screening compound: 3-[({4-[(4-PHENYLPIPERAZINO)CARBONYL]CYCLOHEXYL}METHYL)AMINO]-4-(1-PYRROLIDINYL)-3-CYCLOBUTENE-1,2-DIONE

C906-0303 Screening compound: 3-[({4-[(4-PHENYLPIPERAZINO)CARBONYL]CYCLOHEXYL}METHYL)AMINO]-4-(1-PYRROLIDINYL)-3-CYCLOBUTENE-1,2-DIONE
C906-0303 Screening compound: 3-[({4-[(4-PHENYLPIPERAZINO)CARBONYL]CYCLOHEXYL}METHYL)AMINO]-4-(1-PYRROLIDINYL)-3-CYCLOBUTENE-1,2-DIONE alternative view

Chemical Structure Depiction of ChemDiv screening compound C906-0303
3-[({4-[(4-PHENYLPIPERAZINO)CARBONYL]CYCLOHEXYL}METHYL)AMINO]-4-(1-PYRROLIDINYL)-3-CYCLOBUTENE-1,2-DIONE

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

C906-0303

Molecular Formula

C26H34N4O3 (C26 H34 N4 O3)

Compound Name

3-[({4-[(4-PHENYLPIPERAZINO)CARBONYL]CYCLOHEXYL}METHYL)AMINO]-4-(1-PYRROLIDINYL)-3-CYCLOBUTENE-1,2-DIONE

IUPAC name

3-({[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}amino)-4-(pyrrolidin-1-yl)cyclobut-3-ene-12-dione

SMILES

O=C(C1CCC(CNC(C(C2=O)=O)=C2N2CCCC2)CC1)N(CC1)CCN1c1ccccc1

InChI

InChI=1S/C26H34N4O3/c31-24-22(23(25(24)32)29-12-4-5-13-29)27-18-19-8-10-20(11-9-19)26(33)30-16-14-28(15-17-30)21-6-2-1-3-7-21/h1-3,6-7,19-20,27H,4-5,8-18H2

InChI Key

JGHKPYCWDPOGTA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14807342

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.522

Distribution Coefficient, logD

3.522

Water Solubility, LogSw

-3.51

Polar Surface Area

61.325

Acid Dissociation Constant (pKa)

10.89

Base Dissociation Constant (pKb)

4.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.69

C906-0303 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C906-0303 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C906-0303?
Check Price and Availability of C906-0303, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C906-0303 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C906-0303
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C906-0303
  • 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 C906-0303 available by request