SD74-0459 Screening compound: 8-(4-ISOBUTYL-4H-1,2,4-TRIAZOL-3-YL)-6-[(6-METHYLPYRIDIN-3-YL)CARBONYL]-6-AZASPIRO[3.4]OCTANE

SD74-0459 Screening compound: 8-(4-ISOBUTYL-4H-1,2,4-TRIAZOL-3-YL)-6-[(6-METHYLPYRIDIN-3-YL)CARBONYL]-6-AZASPIRO[3.4]OCTANE
SD74-0459 Screening compound: 8-(4-ISOBUTYL-4H-1,2,4-TRIAZOL-3-YL)-6-[(6-METHYLPYRIDIN-3-YL)CARBONYL]-6-AZASPIRO[3.4]OCTANE alternative view

Chemical Structure Depiction of ChemDiv screening compound SD74-0459
8-(4-ISOBUTYL-4H-1,2,4-TRIAZOL-3-YL)-6-[(6-METHYLPYRIDIN-3-YL)CARBONYL]-6-AZASPIRO[3.4]OCTANE

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

SD74-0459

Molecular Formula

C20H27N5O (C20 H27 N5 O)

Compound Name

8-(4-ISOBUTYL-4H-1,2,4-TRIAZOL-3-YL)-6-[(6-METHYLPYRIDIN-3-YL)CARBONYL]-6-AZASPIRO[3.4]OCTANE

IUPAC name

n/a

SMILES

CC(C)Cn1c(C(C2)C3(CCC3)CN2C(c2cnc(C)cc2)=O)nnc1

InChI

InChI=1S/C20H27N5O/c1-14(2)10-25-13-22-23-18(25)17-11-24(12-20(17)7-4-8-20)19(26)16-6-5-15(3)21-9-16/h5-6,9,13-14,17H,4,7-8,10-12H2,1-3H3/t17-/m0/s1

InChI Key

MGISGMHOIDDDCT-KRWDZBQOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.686

Distribution Coefficient, logD

1.685

Water Solubility, LogSw

-1.90

Polar Surface Area

50.671

Acid Dissociation Constant (pKa)

22.41

Base Dissociation Constant (pKb)

4.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

References: we are preparing a list of scientific research reports with SD74-0459 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD74-0459?
Check Price and Availability of SD74-0459, 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 SD74-0459 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD74-0459
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD74-0459
  • 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 SD74-0459 available by request