SC67-1006 Screening compound: [2-benzyl-4-(4-methyl-4H-1,2,4-triazol-3-yl)-2,8-diazaspiro[4.5]dec-8-yl](5-methyl-3-isoxazolyl)methanone

SC67-1006 Screening compound: [2-benzyl-4-(4-methyl-4H-1,2,4-triazol-3-yl)-2,8-diazaspiro[4.5]dec-8-yl](5-methyl-3-isoxazolyl)methanone
SC67-1006 Screening compound: [2-benzyl-4-(4-methyl-4H-1,2,4-triazol-3-yl)-2,8-diazaspiro[4.5]dec-8-yl](5-methyl-3-isoxazolyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SC67-1006
[2-benzyl-4-(4-methyl-4H-1,2,4-triazol-3-yl)-2,8-diazaspiro[4.5]dec-8-yl](5-methyl-3-isoxazolyl)methanone

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

SC67-1006

Molecular Formula

C23H28N6O2 (C23 H28 N6 O2)

Compound Name

[2-benzyl-4-(4-methyl-4H-1,2,4-triazol-3-yl)-2,8-diazaspiro[4.5]dec-8-yl](5-methyl-3-isoxazolyl)methanone

IUPAC name

2-benzyl-8-(5-methyl-12-oxazole-3-carbonyl)-4-(4-methyl-4H-124-triazol-3-yl)-28-diazaspiro[4.5]decane

SMILES

Cc1cc(C(N(CC2)CCC2(CN(Cc2ccccc2)C2)C2c2nncn2C)=O)no1

InChI

InChI=1S/C23H28N6O2/c1-17-12-20(26-31-17)22(30)29-10-8-23(9-11-29)15-28(13-18-6-4-3-5-7-18)14-19(23)21-25-24-16-27(21)2/h3-7,12,16,19H,8-11,13-15H2,1-2H3/t19-/m1/s1

InChI Key

WEOKNTSJCUSEKE-LJQANCHMSA-N

MDL Number (MFCD)

MFCD32258332

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.51

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

1.525

Distribution Coefficient, logD

-0.418

Water Solubility, LogSw

-1.95

Polar Surface Area

66.721

Acid Dissociation Constant (pKa)

24.06

Base Dissociation Constant (pKb)

9.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.83

References: we are preparing a list of scientific research reports with SC67-1006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC67-1006?
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What is the minimum amount of SC67-1006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC67-1006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC67-1006
  • 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 SC67-1006 available by request