C614-6499 Screening compound: N~1~-(5-chloro-2-methylphenyl)-3-(2,4-dimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-3-yl)propanamide

C614-6499 Screening compound: N~1~-(5-chloro-2-methylphenyl)-3-(2,4-dimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-3-yl)propanamide
C614-6499 Screening compound: N~1~-(5-chloro-2-methylphenyl)-3-(2,4-dimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-3-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C614-6499
N~1~-(5-chloro-2-methylphenyl)-3-(2,4-dimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-3-yl)propanamide

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

C614-6499

Molecular Formula

C21H20ClN5O (C21 H20 ClN5 O)

Compound Name

N~1~-(5-chloro-2-methylphenyl)-3-(2,4-dimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-3-yl)propanamide

IUPAC name

N-(5-chloro-2-methylphenyl)-3-{46-dimethyl-37810-tetraazatricyclo[7.4.0.0^{27}]trideca-13581012-hexaen-5-yl}propanamide

SMILES

Cc(ccc(Cl)c1)c1NC(CCc1c(C)n2nc3ncccc3c2nc1C)=O

InChI

InChI=1S/C21H20ClN5O/c1-12-6-7-15(22)11-18(12)25-19(28)9-8-16-13(2)24-21-17-5-4-10-23-20(17)26-27(21)14(16)3/h4-7,10-11H,8-9H2,1-3H3,(H,25,28)

InChI Key

RKCKDAXNTOOUIX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14777038

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.88

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.018

Distribution Coefficient, logD

3.018

Water Solubility, LogSw

-3.51

Polar Surface Area

52.808

Acid Dissociation Constant (pKa)

10.27

Base Dissociation Constant (pKb)

3.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

C614-6499 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C614-6499 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C614-6499?
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What is the minimum amount of C614-6499 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C614-6499
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C614-6499
  • 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 C614-6499 available by request