C720-0561 Screening compound: N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-hydroxy-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamide

C720-0561 Screening compound: N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-hydroxy-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamide
C720-0561 Screening compound: N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-hydroxy-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C720-0561
N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-hydroxy-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-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

C720-0561

Molecular Formula

C22H26N4O3 (C22 H26 N4 O3)

Compound Name

N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-hydroxy-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamide

IUPAC name

N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-hydroxy-9-methyl-4-oxo-4H-pyrido[12-a]pyrimidine-3-carboxamide

SMILES

CCN(CCCNC(C(C(N(C=CC=C1C)C1=N1)=O)=C1O)=O)c1cc(C)ccc1

InChI

InChI=1S/C22H26N4O3/c1-4-25(17-10-5-8-15(2)14-17)12-7-11-23-20(27)18-21(28)24-19-16(3)9-6-13-26(19)22(18)29/h5-6,8-10,13-14,28H,4,7,11-12H2,1-3H3,(H,23,27)

InChI Key

KXDBHKPUCTXQAH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07194571

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.158

Distribution Coefficient, logD

-3.474

Water Solubility, LogSw

-2.47

Polar Surface Area

67.921

Acid Dissociation Constant (pKa)

1.77

Base Dissociation Constant (pKb)

5.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

References: we are preparing a list of scientific research reports with C720-0561 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C720-0561?
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What is the minimum amount of C720-0561 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C720-0561
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C720-0561
  • 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 C720-0561 available by request