D577-0272 Screening compound: 3-(2-chlorophenyl)-1-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea

D577-0272 Screening compound: 3-(2-chlorophenyl)-1-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea
D577-0272 Screening compound: 3-(2-chlorophenyl)-1-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound D577-0272
3-(2-chlorophenyl)-1-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)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

D577-0272

Molecular Formula

C24H27ClN6O (C24 H27 ClN6 O)

Compound Name

3-(2-chlorophenyl)-1-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea

IUPAC name

3-(2-chlorophenyl)-1-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea

SMILES

Cc1cc(Nc(cc2)ccc2NC(Nc(cccc2)c2Cl)=O)nc(NC2CCCCC2)n1

InChI

InChI=1S/C24H27ClN6O/c1-16-15-22(31-23(26-16)28-17-7-3-2-4-8-17)27-18-11-13-19(14-12-18)29-24(32)30-21-10-6-5-9-20(21)25/h5-6,9-15,17H,2-4,7-8H2,1H3,(H2,29,30,32)(H2,26,27,28,31)

InChI Key

NIRKZHISDWHASC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27593513

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.97

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.273

Distribution Coefficient, logD

6.037

Water Solubility, LogSw

-5.99

Polar Surface Area

70.795

Acid Dissociation Constant (pKa)

11.75

Base Dissociation Constant (pKb)

7.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

D577-0272 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Lipid Metabolism Library (9174 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cardiovascular
  • Metabolic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with D577-0272 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D577-0272?
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What is the minimum amount of D577-0272 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D577-0272
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D577-0272
  • 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 D577-0272 available by request