C561-2946 Screening compound: 1,3,5,7-tetramethyl-6-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

C561-2946 Screening compound: 1,3,5,7-tetramethyl-6-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione
C561-2946 Screening compound: 1,3,5,7-tetramethyl-6-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C561-2946
1,3,5,7-tetramethyl-6-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

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

C561-2946

Molecular Formula

C19H27N5O3 (C19 H27 N5 O3)

Compound Name

1,3,5,7-tetramethyl-6-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

IUPAC name

1357-tetramethyl-6-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-1H2H3H4H-pyrido[23-d]pyrimidine-24-dione

SMILES

Cc1c(CCC(N2CCN(C)CC2)=O)c(C)nc(N(C)C(N2C)=O)c1C2=O

InChI

InChI=1S/C19H27N5O3/c1-12-14(6-7-15(25)24-10-8-21(3)9-11-24)13(2)20-17-16(12)18(26)23(5)19(27)22(17)4/h6-11H2,1-5H3

InChI Key

UHDAOXAJARLJOL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14771822

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.086

Distribution Coefficient, logD

0.839

Water Solubility, LogSw

-1.15

Polar Surface Area

61.414

Acid Dissociation Constant (pKa)

22.77

Base Dissociation Constant (pKb)

7.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

C561-2946 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C561-2946 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C561-2946?
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What is the minimum amount of C561-2946 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C561-2946
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C561-2946
  • 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 C561-2946 available by request