L957-0291 Screening compound: N-[3-(azepan-1-yl)butyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide

L957-0291 Screening compound: N-[3-(azepan-1-yl)butyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide
L957-0291 Screening compound: N-[3-(azepan-1-yl)butyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L957-0291
N-[3-(azepan-1-yl)butyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide

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

L957-0291

Molecular Formula

C23H33N5O4S (C23 H33 N5 O4 S)

Compound Name

N-[3-(azepan-1-yl)butyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide

IUPAC name

N-[3-(azepan-1-yl)butyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-134-oxadiazole-2-carboxamide

SMILES

CC(CCNC(c1nnc(-c(cc2)ccc2S(N2CCCC2)(=O)=O)o1)=O)N1CCCCCC1

InChI

InChI=1S/C23H33N5O4S/c1-18(27-14-4-2-3-5-15-27)12-13-24-21(29)23-26-25-22(32-23)19-8-10-20(11-9-19)33(30,31)28-16-6-7-17-28/h8-11,18H,2-7,12-17H2,1H3,(H,24,29)/t18-/m0/s1

InChI Key

RMBHMMWBEYRNEF-SFHVURJKSA-N

MDL Number (MFCD)

MFCD15137704

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.61

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.247

Distribution Coefficient, logD

-0.685

Water Solubility, LogSw

-2.81

Polar Surface Area

91.058

Acid Dissociation Constant (pKa)

13.68

Base Dissociation Constant (pKb)

10.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.90

L957-0291 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Regenerative Medicine Focused Library (23016 compounds)

SmartTM Library (51161 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • Phosphatases

References: we are preparing a list of scientific research reports with L957-0291 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L957-0291?
Check Price and Availability of L957-0291, 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 L957-0291 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L957-0291
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L957-0291
  • 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 L957-0291 available by request