C561-1611 Screening compound: 3-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-hexylpropanamide

C561-1611 Screening compound: 3-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-hexylpropanamide
C561-1611 Screening compound: 3-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-hexylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C561-1611
3-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-hexylpropanamide

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

C561-1611

Molecular Formula

C16H25N5O (C16 H25 N5 O)

Compound Name

3-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-hexylpropanamide

IUPAC name

3-{57-dimethyl-[124]triazolo[15-a]pyrimidin-6-yl}-N-hexylpropanamide

SMILES

CCCCCCNC(CCc1c(C)n2ncnc2nc1C)=O

InChI

InChI=1S/C16H25N5O/c1-4-5-6-7-10-17-15(22)9-8-14-12(2)20-16-18-11-19-21(16)13(14)3/h11H,4-10H2,1-3H3,(H,17,22)

InChI Key

KCAWUWYAFGRQBV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14771056

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

303.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.979

Distribution Coefficient, logD

1.979

Water Solubility, LogSw

-2.21

Polar Surface Area

56.630

Acid Dissociation Constant (pKa)

14.72

Base Dissociation Constant (pKb)

4.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

62.50

References: we are preparing a list of scientific research reports with C561-1611 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C561-1611?
Check Price and Availability of C561-1611, 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 C561-1611 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C561-1611
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C561-1611
  • 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 C561-1611 available by request