C700-1026 Screening compound: 2-{11-BENZYL-10-METHYL-12-OXO-1811-TRIAZATRICYCLO[7.4.0.0{27}]TRIDECA-2468-TETRAEN-13-YL}-N-[2-(4-CHLOROPHENYL)ETHYL]ACETAMIDE

C700-1026 Screening compound: 2-{11-BENZYL-10-METHYL-12-OXO-1811-TRIAZATRICYCLO[7.4.0.0{27}]TRIDECA-2468-TETRAEN-13-YL}-N-[2-(4-CHLOROPHENYL)ETHYL]ACETAMIDE
C700-1026 Screening compound: 2-{11-BENZYL-10-METHYL-12-OXO-1811-TRIAZATRICYCLO[7.4.0.0{27}]TRIDECA-2468-TETRAEN-13-YL}-N-[2-(4-CHLOROPHENYL)ETHYL]ACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C700-1026
2-{11-BENZYL-10-METHYL-12-OXO-1811-TRIAZATRICYCLO[7.4.0.0{27}]TRIDECA-2468-TETRAEN-13-YL}-N-[2-(4-CHLOROPHENYL)ETHYL]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

C700-1026

Molecular Formula

C28H27ClN4O2 (C28 H27 ClN4 O2)

Compound Name

2-{11-BENZYL-10-METHYL-12-OXO-1811-TRIAZATRICYCLO[7.4.0.0{27}]TRIDECA-2468-TETRAEN-13-YL}-N-[2-(4-CHLOROPHENYL)ETHYL]ACETAMIDE

IUPAC name

n/a

SMILES

CC(c1nc(cccc2)c2n1C1CC(NCCc(cc2)ccc2Cl)=O)N(Cc2ccccc2)C1=O

InChI

InChI=1S/C28H27ClN4O2/c1-19-27-31-23-9-5-6-10-24(23)33(27)25(28(35)32(19)18-21-7-3-2-4-8-21)17-26(34)30-16-15-20-11-13-22(29)14-12-20/h2-14,19,25H,15-18H2,1H3,(H,30,34)

InChI Key

YAPOMSZYWSIKRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14785203

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.877

Distribution Coefficient, logD

3.877

Water Solubility, LogSw

-4.37

Polar Surface Area

50.628

Acid Dissociation Constant (pKa)

13.77

Base Dissociation Constant (pKb)

2.64

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

25.00

C700-1026 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

DGK Inhibitors Library (10558 compounds)

GPCR Targeted Library (31838 compounds)

New Agro Library (44492 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • GPCR
  • Phosphatases
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C700-1026 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C700-1026?
Check Price and Availability of C700-1026, 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 C700-1026 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C700-1026
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C700-1026
  • 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 C700-1026 available by request