C720-0498 Screening compound: 3-(2,3-dihydro-1H-indol-1-ylcarbonyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

C720-0498 Screening compound: 3-(2,3-dihydro-1H-indol-1-ylcarbonyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
C720-0498 Screening compound: 3-(2,3-dihydro-1H-indol-1-ylcarbonyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C720-0498
3-(2,3-dihydro-1H-indol-1-ylcarbonyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-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

C720-0498

Molecular Formula

C18H15N3O2 (C18 H15 N3 O2)

Compound Name

3-(2,3-dihydro-1H-indol-1-ylcarbonyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

IUPAC name

3-(23-dihydro-1H-indole-1-carbonyl)-7-methyl-4H-pyrido[12-a]pyrimidin-4-one

SMILES

CC(C=CC1=NC=C2C(N(CC3)c4c3cccc4)=O)=CN1C2=O

InChI

InChI=1S/C18H15N3O2/c1-12-6-7-16-19-10-14(18(23)21(16)11-12)17(22)20-9-8-13-4-2-3-5-15(13)20/h2-7,10-11H,8-9H2,1H3

InChI Key

NDDTXLFXZLTLDY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06722218

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

305.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.811

Distribution Coefficient, logD

1.811

Water Solubility, LogSw

-1.93

Polar Surface Area

41.671

Acid Dissociation Constant (pKa)

26.03

Base Dissociation Constant (pKb)

0.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

C720-0498 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 C720-0498 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C720-0498?
Check Price and Availability of C720-0498, 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 C720-0498 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C720-0498
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C720-0498
  • 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 C720-0498 available by request