L701-0589 Screening compound: 1-(morpholin-4-yl)-3-{5-[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]-1H-1,2,3-benzotriazol-1-yl}propan-1-one

L701-0589 Screening compound: 1-(morpholin-4-yl)-3-{5-[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]-1H-1,2,3-benzotriazol-1-yl}propan-1-one
L701-0589 Screening compound: 1-(morpholin-4-yl)-3-{5-[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]-1H-1,2,3-benzotriazol-1-yl}propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound L701-0589
1-(morpholin-4-yl)-3-{5-[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]-1H-1,2,3-benzotriazol-1-yl}propan-1-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

L701-0589

Molecular Formula

C19H18N6O3S (C19 H18 N6 O3 S)

Compound Name

1-(morpholin-4-yl)-3-{5-[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]-1H-1,2,3-benzotriazol-1-yl}propan-1-one

IUPAC name

1-(morpholin-4-yl)-3-{5-[5-(thiophen-2-yl)-124-oxadiazol-3-yl]-1H-123-benzotriazol-1-yl}propan-1-one

SMILES

O=C(CCn1nnc2c1ccc(-c1noc(-c3cccs3)n1)c2)N1CCOCC1

InChI

InChI=1S/C19H18N6O3S/c26-17(24-7-9-27-10-8-24)5-6-25-15-4-3-13(12-14(15)21-23-25)18-20-19(28-22-18)16-2-1-11-29-16/h1-4,11-12H,5-10H2

InChI Key

ZHJJBYGIJIFOMH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27470957

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.104

Distribution Coefficient, logD

2.104

Water Solubility, LogSw

-2.70

Polar Surface Area

82.368

Acid Dissociation Constant (pKa)

23.39

Base Dissociation Constant (pKb)

-0.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with L701-0589 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L701-0589?
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What is the minimum amount of L701-0589 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L701-0589
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L701-0589
  • 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 L701-0589 available by request