D715-0133 Screening compound: 2-(3-methoxyphenyl)-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[5,1-a]beta-carboline-1,3(2H)-dione

D715-0133 Screening compound: 2-(3-methoxyphenyl)-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[5,1-a]beta-carboline-1,3(2H)-dione
D715-0133 Screening compound: 2-(3-methoxyphenyl)-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[5,1-a]beta-carboline-1,3(2H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D715-0133
2-(3-methoxyphenyl)-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[5,1-a]beta-carboline-1,3(2H)-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

D715-0133

Molecular Formula

C21H19N3O3 (C21 H19 N3 O3)

Compound Name

2-(3-methoxyphenyl)-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[5,1-a]beta-carboline-1,3(2H)-dione

IUPAC name

4-(3-methoxyphenyl)-2-methyl-4616-triazatetracyclo[7.7.0.0^{26}.0^{1015}]hexadeca-1(9)101214-tetraene-35-dione

SMILES

CC(c1c(CC2)c(cccc3)c3[nH]1)(C(N1c3cc(OC)ccc3)=O)N2C1=O

InChI

InChI=1S/C21H19N3O3/c1-21-18-16(15-8-3-4-9-17(15)22-18)10-11-23(21)20(26)24(19(21)25)13-6-5-7-14(12-13)27-2/h3-9,12,22H,10-11H2,1-2H3/t21-/m0/s1

InChI Key

RMHNZTDCRMOGAE-NRFANRHFSA-N

MDL Number (MFCD)

MFCD10040473

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.249

Distribution Coefficient, logD

3.249

Water Solubility, LogSw

-3.56

Polar Surface Area

49.486

Acid Dissociation Constant (pKa)

18.51

Base Dissociation Constant (pKb)

-3.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.80

D715-0133 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

DGK Inhibitors Library (10558 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with D715-0133 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D715-0133?
Check Price and Availability of D715-0133, 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 D715-0133 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D715-0133
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D715-0133
  • 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 D715-0133 available by request