D083-0076 Screening compound: pentyl 4-[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]benzoate

D083-0076 Screening compound: pentyl 4-[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]benzoate
D083-0076 Screening compound: pentyl 4-[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D083-0076
pentyl 4-[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]benzoate

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

D083-0076

Molecular Formula

C19H25N3O3 (C19 H25 N3 O3)

Compound Name

pentyl 4-[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]benzoate

IUPAC name

pentyl 4-[(6-oxo-4-propyl-16-dihydropyrimidin-2-yl)amino]benzoate

SMILES

CCCCCOC(c(cc1)ccc1NC(N1)=NC(CCC)=CC1=O)=O

InChI

InChI=1S/C19H25N3O3/c1-3-5-6-12-25-18(24)14-8-10-15(11-9-14)20-19-21-16(7-4-2)13-17(23)22-19/h8-11,13H,3-7,12H2,1-2H3,(H2,20,21,22,23)

InChI Key

WVOVYRGFGUJKCQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08143117

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.852

Distribution Coefficient, logD

4.818

Water Solubility, LogSw

-4.57

Polar Surface Area

66.011

Acid Dissociation Constant (pKa)

8.49

Base Dissociation Constant (pKb)

1.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

References: we are preparing a list of scientific research reports with D083-0076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D083-0076?
Check Price and Availability of D083-0076, 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 D083-0076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D083-0076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D083-0076
  • 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 D083-0076 available by request