C734-0677 Screening compound: 2-{1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-[3-(3,4,5-trimethoxyphenyl)-1,2-oxazol-5-yl]acetamide

C734-0677 Screening compound: 2-{1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-[3-(3,4,5-trimethoxyphenyl)-1,2-oxazol-5-yl]acetamide
C734-0677 Screening compound: 2-{1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-[3-(3,4,5-trimethoxyphenyl)-1,2-oxazol-5-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C734-0677
2-{1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-[3-(3,4,5-trimethoxyphenyl)-1,2-oxazol-5-yl]acetamide

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

C734-0677

Molecular Formula

C24H22N4O6 (C24 H22 N4 O6)

Compound Name

2-{1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-[3-(3,4,5-trimethoxyphenyl)-1,2-oxazol-5-yl]acetamide

IUPAC name

2-{1H4H-chromeno[43-c]pyrazol-1-yl}-N-[3-(345-trimethoxyphenyl)-12-oxazol-5-yl]acetamide

SMILES

COc1cc(-c2noc(NC(Cn3ncc4c3-c(cccc3)c3OC4)=O)c2)cc(OC)c1OC

InChI

InChI=1S/C24H22N4O6/c1-30-19-8-14(9-20(31-2)24(19)32-3)17-10-22(34-27-17)26-21(29)12-28-23-15(11-25-28)13-33-18-7-5-4-6-16(18)23/h4-11H,12-13H2,1-3H3,(H,26,29)

InChI Key

WSCQEGDGGFTJNG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14789729

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.46

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.873

Distribution Coefficient, logD

2.873

Water Solubility, LogSw

-3.36

Polar Surface Area

90.315

Acid Dissociation Constant (pKa)

10.83

Base Dissociation Constant (pKb)

-3.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

C734-0677 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C734-0677 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C734-0677?
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What is the minimum amount of C734-0677 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C734-0677
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C734-0677
  • 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 C734-0677 available by request