C614-5988 Screening compound: 6-(2,4,5-trimethoxyphenyl)-1,5-diazabicyclo[3.1.0]hexane

C614-5988 Screening compound: 6-(2,4,5-trimethoxyphenyl)-1,5-diazabicyclo[3.1.0]hexane
C614-5988 Screening compound: 6-(2,4,5-trimethoxyphenyl)-1,5-diazabicyclo[3.1.0]hexane alternative view

Chemical Structure Depiction of ChemDiv screening compound C614-5988
6-(2,4,5-trimethoxyphenyl)-1,5-diazabicyclo[3.1.0]hexane

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

C614-5988

Molecular Formula

C13H18N2O3 (C13 H18 N2 O3)

Compound Name

6-(2,4,5-trimethoxyphenyl)-1,5-diazabicyclo[3.1.0]hexane

IUPAC name

6-(245-trimethoxyphenyl)-15-diazabicyclo[3.1.0]hexane

SMILES

COc(c(C1N2N1CCC2)c1)cc(OC)c1OC

InChI

InChI=1S/C13H18N2O3/c1-16-10-8-12(18-3)11(17-2)7-9(10)13-14-5-4-6-15(13)14/h7-8,13H,4-6H2,1-3H3

InChI Key

PSKQQSHGVLHBDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14776764

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

250.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.505

Distribution Coefficient, logD

1.505

Water Solubility, LogSw

-1.66

Polar Surface Area

30.782

Acid Dissociation Constant (pKa)

27.67

Base Dissociation Constant (pKb)

3.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.80

C614-5988 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C614-5988 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C614-5988?
Check Price and Availability of C614-5988, 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 C614-5988 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C614-5988
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C614-5988
  • 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 C614-5988 available by request