8017-3251 Screening compound: N~1~-(2,4-dichlorophenyl)-2-{[5-(3-pyridyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

8017-3251 Screening compound: N~1~-(2,4-dichlorophenyl)-2-{[5-(3-pyridyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
8017-3251 Screening compound: N~1~-(2,4-dichlorophenyl)-2-{[5-(3-pyridyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-3251
N~1~-(2,4-dichlorophenyl)-2-{[5-(3-pyridyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

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

8017-3251

Molecular Formula

C15H11Cl2N5OS (C15 H11 Cl2 N5 OS)

Compound Name

N~1~-(2,4-dichlorophenyl)-2-{[5-(3-pyridyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

IUPAC name

n/a

SMILES

O=C(CSc1nnc(-c2cnccc2)[nH]1)Nc(ccc(Cl)c1)c1Cl

InChI

InChI=1S/C15H11Cl2N5OS/c16-10-3-4-12(11(17)6-10)19-13(23)8-24-15-20-14(21-22-15)9-2-1-5-18-7-9/h1-7H,8H2,(H,19,23)(H,20,21,22)

InChI Key

XMPWKUGLCAGIFB-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.26

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.425

Distribution Coefficient, logD

1.308

Water Solubility, LogSw

-3.28

Polar Surface Area

64.443

Acid Dissociation Constant (pKa)

5.17

Base Dissociation Constant (pKb)

5.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

References: we are preparing a list of scientific research reports with 8017-3251 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-3251?
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What is the minimum amount of 8017-3251 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-3251
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-3251
  • 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 8017-3251 available by request