SD74-0280 Screening compound: 4-{2-[8-(4-CYCLOPROPYL-4H-1,2,4-TRIAZOL-3-YL)-6-AZASPIRO[3.4]OCT-6-YL]-2-OXOETHYL}-2H-1,4-BENZOXAZIN-3(4H)-ONE

SD74-0280 Screening compound: 4-{2-[8-(4-CYCLOPROPYL-4H-1,2,4-TRIAZOL-3-YL)-6-AZASPIRO[3.4]OCT-6-YL]-2-OXOETHYL}-2H-1,4-BENZOXAZIN-3(4H)-ONE
SD74-0280 Screening compound: 4-{2-[8-(4-CYCLOPROPYL-4H-1,2,4-TRIAZOL-3-YL)-6-AZASPIRO[3.4]OCT-6-YL]-2-OXOETHYL}-2H-1,4-BENZOXAZIN-3(4H)-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound SD74-0280
4-{2-[8-(4-CYCLOPROPYL-4H-1,2,4-TRIAZOL-3-YL)-6-AZASPIRO[3.4]OCT-6-YL]-2-OXOETHYL}-2H-1,4-BENZOXAZIN-3(4H)-ONE

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

SD74-0280

Molecular Formula

C22H25N5O3 (C22 H25 N5 O3)

Compound Name

4-{2-[8-(4-CYCLOPROPYL-4H-1,2,4-TRIAZOL-3-YL)-6-AZASPIRO[3.4]OCT-6-YL]-2-OXOETHYL}-2H-1,4-BENZOXAZIN-3(4H)-ONE

IUPAC name

n/a

SMILES

O=C(CN1c(cccc2)c2OCC1=O)N(C1)CC2(CCC2)C1c1nncn1C1CC1

InChI

InChI=1S/C22H25N5O3/c28-19(11-26-17-4-1-2-5-18(17)30-12-20(26)29)25-10-16(22(13-25)8-3-9-22)21-24-23-14-27(21)15-6-7-15/h1-2,4-5,14-16H,3,6-13H2/t16-/m0/s1

InChI Key

LIROGFFSAWCQBF-INIZCTEOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.825

Distribution Coefficient, logD

0.825

Water Solubility, LogSw

-1.61

Polar Surface Area

65.653

Acid Dissociation Constant (pKa)

19.34

Base Dissociation Constant (pKb)

5.89

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

54.50

References: we are preparing a list of scientific research reports with SD74-0280 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD74-0280?
Check Price and Availability of SD74-0280, 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 SD74-0280 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD74-0280
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD74-0280
  • 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 SD74-0280 available by request