K279-0579 Screening compound: 2-({3-[3-(BUTYLAMINO)-3-OXOPROPYL]-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL}SULFANYL)-N~1~-(3-METHOXYPROPYL)BUTANAMIDE

K279-0579 Screening compound: 2-({3-[3-(BUTYLAMINO)-3-OXOPROPYL]-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL}SULFANYL)-N~1~-(3-METHOXYPROPYL)BUTANAMIDE
K279-0579 Screening compound: 2-({3-[3-(BUTYLAMINO)-3-OXOPROPYL]-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL}SULFANYL)-N~1~-(3-METHOXYPROPYL)BUTANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound K279-0579
2-({3-[3-(BUTYLAMINO)-3-OXOPROPYL]-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL}SULFANYL)-N~1~-(3-METHOXYPROPYL)BUTANAMIDE

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

K279-0579

Molecular Formula

C25H35N5O4S (C25 H35 N5 O4 S)

Compound Name

2-({3-[3-(BUTYLAMINO)-3-OXOPROPYL]-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-5-YL}SULFANYL)-N~1~-(3-METHOXYPROPYL)BUTANAMIDE

IUPAC name

n/a

SMILES

CCCCNC(CCC1N2C(SC(CC)C(NCCCOC)=O)=Nc(cccc3)c3C2=NC1=O)=O

InChI

InChI=1S/C25H35N5O4S/c1-4-6-14-26-21(31)13-12-19-23(32)29-22-17-10-7-8-11-18(17)28-25(30(19)22)35-20(5-2)24(33)27-15-9-16-34-3/h7-8,10-11,19-20H,4-6,9,12-16H2,1-3H3,(H,26,31)(H,27,33)

InChI Key

RDOKAISCYUCQOD-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

501.65

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.156

Distribution Coefficient, logD

2.155

Water Solubility, LogSw

-2.85

Polar Surface Area

92.877

Acid Dissociation Constant (pKa)

10.29

Base Dissociation Constant (pKb)

4.20

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

56.00

K279-0579 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with K279-0579 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K279-0579?
Check Price and Availability of K279-0579, 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 K279-0579 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K279-0579
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K279-0579
  • 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 K279-0579 available by request