G376-0111 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3,7-trimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxamide

G376-0111 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3,7-trimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxamide
G376-0111 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3,7-trimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G376-0111
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3,7-trimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-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

G376-0111

Molecular Formula

C19H18N4O5 (C19 H18 N4 O5)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3,7-trimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-5-carboxamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-137-trimethyl-24-dioxo-1H2H3H4H-pyrido[23-d]pyrimidine-5-carboxamide

SMILES

Cc(cc1C(NCc(cc2)cc3c2OCO3)=O)nc(N(C)C(N2C)=O)c1C2=O

InChI

InChI=1S/C19H18N4O5/c1-10-6-12(15-16(21-10)22(2)19(26)23(3)18(15)25)17(24)20-8-11-4-5-13-14(7-11)28-9-27-13/h4-7H,8-9H2,1-3H3,(H,20,24)

InChI Key

MMTVQLVHTRSRDB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27138281

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.38

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.364

Distribution Coefficient, logD

2.364

Water Solubility, LogSw

-3.11

Polar Surface Area

82.575

Acid Dissociation Constant (pKa)

12.37

Base Dissociation Constant (pKb)

2.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

G376-0111 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiparasite Library (23996 compounds)

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

Cardiovascular Library (22201 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Immune system
  • animal
  • Cardiovascular
Agro:
  • Agro
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with G376-0111 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G376-0111?
Check Price and Availability of G376-0111, 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 G376-0111 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G376-0111
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G376-0111
  • 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 G376-0111 available by request