C301-7613 Screening compound: 1-(5-chloro-2-methylphenyl)-3-[4-(cyclohexylamino)-2-oxo-2H-chromen-3-yl]urea

C301-7613 Screening compound: 1-(5-chloro-2-methylphenyl)-3-[4-(cyclohexylamino)-2-oxo-2H-chromen-3-yl]urea
C301-7613 Screening compound: 1-(5-chloro-2-methylphenyl)-3-[4-(cyclohexylamino)-2-oxo-2H-chromen-3-yl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-7613
1-(5-chloro-2-methylphenyl)-3-[4-(cyclohexylamino)-2-oxo-2H-chromen-3-yl]urea

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

C301-7613

Molecular Formula

C23H24ClN3O3 (C23 H24 ClN3 O3)

Compound Name

1-(5-chloro-2-methylphenyl)-3-[4-(cyclohexylamino)-2-oxo-2H-chromen-3-yl]urea

IUPAC name

1-(5-chloro-2-methylphenyl)-3-[4-(cyclohexylamino)-2-oxo-2H-chromen-3-yl]urea

SMILES

Cc(ccc(Cl)c1)c1NC(NC(C(Oc1c2cccc1)=O)=C2NC1CCCCC1)=O

InChI

InChI=1S/C23H24ClN3O3/c1-14-11-12-15(24)13-18(14)26-23(29)27-21-20(25-16-7-3-2-4-8-16)17-9-5-6-10-19(17)30-22(21)28/h5-6,9-13,16,25H,2-4,7-8H2,1H3,(H2,26,27,29)

InChI Key

WQTZHZNTLQWFOP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14745021

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.91

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.954

Distribution Coefficient, logD

4.859

Water Solubility, LogSw

-5.03

Polar Surface Area

63.123

Acid Dissociation Constant (pKa)

8.02

Base Dissociation Constant (pKb)

-4.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

C301-7613 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • Others
  • GPCR
Mechanism of action:
  • Epigenetic
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C301-7613 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-7613?
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What is the minimum amount of C301-7613 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-7613
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-7613
  • 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 C301-7613 available by request