Y020-3315 Screening compound: 7-(3,4-dimethoxyphenethyl)pyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-6(7H)-one

Y020-3315 Screening compound: 7-(3,4-dimethoxyphenethyl)pyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-6(7H)-one
Y020-3315 Screening compound: 7-(3,4-dimethoxyphenethyl)pyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-6(7H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-3315
7-(3,4-dimethoxyphenethyl)pyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-6(7H)-one

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

Y020-3315

Molecular Formula

C18H17N5O3 (C18 H17 N5 O3)

Compound Name

7-(3,4-dimethoxyphenethyl)pyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-6(7H)-one

IUPAC name

11-[2-(34-dimethoxyphenyl)ethyl]-237811-pentaazatricyclo[7.4.0.0^{26}]trideca-1(9)35712-pentaen-10-one

SMILES

COc(ccc(CCN(C=Cc1c2nnc3ccnn13)C2=O)c1)c1OC

InChI

InChI=1S/C18H17N5O3/c1-25-14-4-3-12(11-15(14)26-2)6-9-22-10-7-13-17(18(22)24)21-20-16-5-8-19-23(13)16/h3-5,7-8,10-11H,6,9H2,1-2H3

InChI Key

LXIAPIOQVLDKGP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15196084

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.067

Distribution Coefficient, logD

2.067

Water Solubility, LogSw

-2.41

Polar Surface Area

69.294

Acid Dissociation Constant (pKa)

26.44

Base Dissociation Constant (pKb)

2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

Y020-3315 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with Y020-3315 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-3315?
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What is the minimum amount of Y020-3315 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-3315
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-3315
  • 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 Y020-3315 available by request