4900-0038 Screening compound: 10-methoxy-2,4,5,6-tetrahydro-1H-pyrazino[1,2,3-lm]beta-carboline

4900-0038 Screening compound: 10-methoxy-2,4,5,6-tetrahydro-1H-pyrazino[1,2,3-lm]beta-carboline
4900-0038 Screening compound: 10-methoxy-2,4,5,6-tetrahydro-1H-pyrazino[1,2,3-lm]beta-carboline alternative view

Chemical Structure Depiction of ChemDiv screening compound 4900-0038
10-methoxy-2,4,5,6-tetrahydro-1H-pyrazino[1,2,3-lm]beta-carboline

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

4900-0038

Molecular Formula

C14H15N3O (C14 H15 N3 O)

Compound Name

10-methoxy-2,4,5,6-tetrahydro-1H-pyrazino[1,2,3-lm]beta-carboline

IUPAC name

12-methoxy-146-triazatetracyclo[7.6.1.0^{516}.0^{1015}]hexadeca-59(16)10(15)1113-pentaene

SMILES

COc(cc1)cc2c1n1c3c2CCN=C3NCC1

InChI

InChI=1S/C14H15N3O/c1-18-9-2-3-12-11(8-9)10-4-5-15-14-13(10)17(12)7-6-16-14/h2-3,8H,4-7H2,1H3,(H,15,16)

InChI Key

LKCZMMHEFGFZGG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03448135

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

241.29

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.497

Distribution Coefficient, logD

0.243

Water Solubility, LogSw

-2.78

Polar Surface Area

29.509

Acid Dissociation Constant (pKa)

14.49

Base Dissociation Constant (pKb)

9.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

4900-0038 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 4900-0038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4900-0038?
Check Price and Availability of 4900-0038, 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 4900-0038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4900-0038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4900-0038
  • 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 4900-0038 available by request