8015-8727 Screening compound: N-(5-chloro-2-methoxyphenyl)-N''-(4-oxo-4,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-2-yl)guanidine

8015-8727 Screening compound: N-(5-chloro-2-methoxyphenyl)-N''-(4-oxo-4,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-2-yl)guanidine
8015-8727 Screening compound: N-(5-chloro-2-methoxyphenyl)-N''-(4-oxo-4,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-2-yl)guanidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-8727
N-(5-chloro-2-methoxyphenyl)-N''-(4-oxo-4,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-2-yl)guanidine

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

8015-8727

Molecular Formula

C15H16ClN5O2 (C15 H16 ClN5 O2)

Compound Name

N-(5-chloro-2-methoxyphenyl)-N''-(4-oxo-4,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-2-yl)guanidine

IUPAC name

(E)-N-(5-chloro-2-methoxyphenyl)-N''-{4-oxo-1H4H5H6H7H-cyclopenta[d]pyrimidin-2-yl}guanidine

SMILES

COc(ccc(Cl)c1)c1N/C(/N)=N/C(NC1=C2CCC1)=NC2=O

InChI

InChI=1S/C15H16ClN5O2/c1-23-12-6-5-8(16)7-11(12)18-14(17)21-15-19-10-4-2-3-9(10)13(22)20-15/h5-7H,2-4H2,1H3,(H4,17,18,19,20,21,22)

InChI Key

NRUNXFHPUPDVSZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03669063

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.78

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.721

Distribution Coefficient, logD

1.721

Water Solubility, LogSw

-2.75

Polar Surface Area

80.865

Acid Dissociation Constant (pKa)

9.31

Base Dissociation Constant (pKb)

8.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.67

References: we are preparing a list of scientific research reports with 8015-8727 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-8727?
Check Price and Availability of 8015-8727, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8015-8727 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-8727
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-8727
  • 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 8015-8727 available by request