8602-0435 Screening compound: 6-cyclohexyl-1-(2-fluorophenyl)-1H,2H,3H,4H,5H,6H,7H,8H-[1,3]diazino[4,5-d]pyrimidine-2,4-dione

8602-0435 Screening compound: 6-cyclohexyl-1-(2-fluorophenyl)-1H,2H,3H,4H,5H,6H,7H,8H-[1,3]diazino[4,5-d]pyrimidine-2,4-dione
8602-0435 Screening compound: 6-cyclohexyl-1-(2-fluorophenyl)-1H,2H,3H,4H,5H,6H,7H,8H-[1,3]diazino[4,5-d]pyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8602-0435
6-cyclohexyl-1-(2-fluorophenyl)-1H,2H,3H,4H,5H,6H,7H,8H-[1,3]diazino[4,5-d]pyrimidine-2,4-dione

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

8602-0435

Molecular Formula

C18H21FN4O2 (C18 H21 FN4 O2)

Compound Name

6-cyclohexyl-1-(2-fluorophenyl)-1H,2H,3H,4H,5H,6H,7H,8H-[1,3]diazino[4,5-d]pyrimidine-2,4-dione

IUPAC name

6-cyclohexyl-1-(2-fluorophenyl)-1H2H3H4H5H6H7H8H-[13]diazino[45-d]pyrimidine-24-dione

SMILES

O=C(C(CN(CN1)C2CCCCC2)=C1N1c(cccc2)c2F)NC1=O

InChI

InChI=1S/C18H21FN4O2/c19-14-8-4-5-9-15(14)23-16-13(17(24)21-18(23)25)10-22(11-20-16)12-6-2-1-3-7-12/h4-5,8-9,12,20H,1-3,6-7,10-11H2,(H,21,24,25)

InChI Key

HVWBWZRSYCSRAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08098357

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.448

Distribution Coefficient, logD

2.379

Water Solubility, LogSw

-2.78

Polar Surface Area

52.723

Acid Dissociation Constant (pKa)

10.57

Base Dissociation Constant (pKb)

6.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

References: we are preparing a list of scientific research reports with 8602-0435 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8602-0435?
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What is the minimum amount of 8602-0435 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8602-0435
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8602-0435
  • 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 8602-0435 available by request