T475-0089 Screening compound: N-[(2-chlorophenyl)methyl]-4-methyl-3-oxo-3H,4H-pyrido[2,3-b]pyrazine-2-carboxamide

T475-0089 Screening compound: N-[(2-chlorophenyl)methyl]-4-methyl-3-oxo-3H,4H-pyrido[2,3-b]pyrazine-2-carboxamide
T475-0089 Screening compound: N-[(2-chlorophenyl)methyl]-4-methyl-3-oxo-3H,4H-pyrido[2,3-b]pyrazine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T475-0089
N-[(2-chlorophenyl)methyl]-4-methyl-3-oxo-3H,4H-pyrido[2,3-b]pyrazine-2-carboxamide

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

T475-0089

Molecular Formula

C16H13ClN4O2 (C16 H13 ClN4 O2)

Compound Name

N-[(2-chlorophenyl)methyl]-4-methyl-3-oxo-3H,4H-pyrido[2,3-b]pyrazine-2-carboxamide

IUPAC name

N-[(2-chlorophenyl)methyl]-4-methyl-3-oxo-3H4H-pyrido[23-b]pyrazine-2-carboxamide

SMILES

CN(c(nccc1)c1N=C1C(NCc(cccc2)c2Cl)=O)C1=O

InChI

InChI=1S/C16H13ClN4O2/c1-21-14-12(7-4-8-18-14)20-13(16(21)23)15(22)19-9-10-5-2-3-6-11(10)17/h2-8H,9H2,1H3,(H,19,22)

InChI Key

OLYFGQUYONAJCR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27621394

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.76

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.787

Distribution Coefficient, logD

1.786

Water Solubility, LogSw

-2.41

Polar Surface Area

58.231

Acid Dissociation Constant (pKa)

10.93

Base Dissociation Constant (pKb)

-1.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

T475-0089 in Drug Discovery

Included in Screening Libraries

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

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with T475-0089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T475-0089?
Check Price and Availability of T475-0089, 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 T475-0089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T475-0089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T475-0089
  • 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 T475-0089 available by request