D283-0089 Screening compound: 2-{1-[2,5-diethoxy-4-(1H-1,2,3,4-tetrazol-1-yl)benzenesulfonyl]piperidin-3-yl}-2H-1,2,3-benzotriazole

D283-0089 Screening compound: 2-{1-[2,5-diethoxy-4-(1H-1,2,3,4-tetrazol-1-yl)benzenesulfonyl]piperidin-3-yl}-2H-1,2,3-benzotriazole
D283-0089 Screening compound: 2-{1-[2,5-diethoxy-4-(1H-1,2,3,4-tetrazol-1-yl)benzenesulfonyl]piperidin-3-yl}-2H-1,2,3-benzotriazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D283-0089
2-{1-[2,5-diethoxy-4-(1H-1,2,3,4-tetrazol-1-yl)benzenesulfonyl]piperidin-3-yl}-2H-1,2,3-benzotriazole

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

D283-0089

Molecular Formula

C22H26N8O4S (C22 H26 N8 O4 S)

Compound Name

2-{1-[2,5-diethoxy-4-(1H-1,2,3,4-tetrazol-1-yl)benzenesulfonyl]piperidin-3-yl}-2H-1,2,3-benzotriazole

IUPAC name

2-{1-[25-diethoxy-4-(1H-1234-tetrazol-1-yl)benzenesulfonyl]piperidin-3-yl}-2H-123-benzotriazole

SMILES

CCOc(c(-n1nnnc1)c1)cc(S(N(CCC2)CC2n2nc(cccc3)c3n2)(=O)=O)c1OCC

InChI

InChI=1S/C22H26N8O4S/c1-3-33-20-13-22(21(34-4-2)12-19(20)29-15-23-26-27-29)35(31,32)28-11-7-8-16(14-28)30-24-17-9-5-6-10-18(17)25-30/h5-6,9-10,12-13,15-16H,3-4,7-8,11,14H2,1-2H3/t16-/m0/s1

InChI Key

KCQKDHSMUUWOMQ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14816723

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.57

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

2.964

Distribution Coefficient, logD

2.964

Water Solubility, LogSw

-3.37

Polar Surface Area

109.443

Acid Dissociation Constant (pKa)

27.24

Base Dissociation Constant (pKb)

-0.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

References: we are preparing a list of scientific research reports with D283-0089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D283-0089?
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What is the minimum amount of D283-0089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D283-0089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D283-0089
  • 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 D283-0089 available by request