C430-1234 Screening compound: 3-[4,5-dimethyl-7-oxo-2-(3,4,5-trimethoxyphenyl)-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl]propanoic acid

C430-1234 Screening compound: 3-[4,5-dimethyl-7-oxo-2-(3,4,5-trimethoxyphenyl)-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl]propanoic acid
C430-1234 Screening compound: 3-[4,5-dimethyl-7-oxo-2-(3,4,5-trimethoxyphenyl)-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl]propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C430-1234
3-[4,5-dimethyl-7-oxo-2-(3,4,5-trimethoxyphenyl)-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl]propanoic acid

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

C430-1234

Molecular Formula

C20H23N3O6 (C20 H23 N3 O6)

Compound Name

3-[4,5-dimethyl-7-oxo-2-(3,4,5-trimethoxyphenyl)-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl]propanoic acid

IUPAC name

3-[45-dimethyl-7-oxo-2-(345-trimethoxyphenyl)-4H7H-pyrazolo[15-a]pyrimidin-6-yl]propanoic acid

SMILES

CC(N(C)c1cc(-c(cc2OC)cc(OC)c2OC)nn11)=C(CCC(O)=O)C1=O

InChI

InChI=1S/C20H23N3O6/c1-11-13(6-7-18(24)25)20(26)23-17(22(11)2)10-14(21-23)12-8-15(27-3)19(29-5)16(9-12)28-4/h8-10H,6-7H2,1-5H3,(H,24,25)

InChI Key

OHHWRCHEOIBOCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14756768

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.42

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.693

Distribution Coefficient, logD

-0.804

Water Solubility, LogSw

-1.79

Polar Surface Area

78.541

Acid Dissociation Constant (pKa)

4.91

Base Dissociation Constant (pKb)

-2.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

C430-1234 in Drug Discovery

Included in Screening Libraries

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 C430-1234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C430-1234?
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What is the minimum amount of C430-1234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C430-1234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C430-1234
  • 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 C430-1234 available by request