D600-0165 Screening compound: methyl 4-{3-[(3-methoxyphenyl)amino]imidazo[1,2-a]pyrazin-2-yl}benzoate

D600-0165 Screening compound: methyl 4-{3-[(3-methoxyphenyl)amino]imidazo[1,2-a]pyrazin-2-yl}benzoate
D600-0165 Screening compound: methyl 4-{3-[(3-methoxyphenyl)amino]imidazo[1,2-a]pyrazin-2-yl}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D600-0165
methyl 4-{3-[(3-methoxyphenyl)amino]imidazo[1,2-a]pyrazin-2-yl}benzoate

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

D600-0165

Molecular Formula

C21H18N4O3 (C21 H18 N4 O3)

Compound Name

methyl 4-{3-[(3-methoxyphenyl)amino]imidazo[1,2-a]pyrazin-2-yl}benzoate

IUPAC name

methyl 4-{3-[(3-methoxyphenyl)amino]imidazo[12-a]pyrazin-2-yl}benzoate

SMILES

COC(c(cc1)ccc1-c1c(Nc2cc(OC)ccc2)n(ccnc2)c2n1)=O

InChI

InChI=1S/C21H18N4O3/c1-27-17-5-3-4-16(12-17)23-20-19(24-18-13-22-10-11-25(18)20)14-6-8-15(9-7-14)21(26)28-2/h3-13,23H,1-2H3

InChI Key

VVPLSLZSLPSJGT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27594482

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.782

Distribution Coefficient, logD

3.781

Water Solubility, LogSw

-3.86

Polar Surface Area

55.914

Acid Dissociation Constant (pKa)

19.08

Base Dissociation Constant (pKb)

4.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

D600-0165 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with D600-0165 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D600-0165?
Check Price and Availability of D600-0165, 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 D600-0165 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D600-0165
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D600-0165
  • 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 D600-0165 available by request