8009-6518 Screening compound: N~2~-[2-(1-naphthyloxy)ethyl]-1-(2-naphthylsulfonyl)-2-pyrrolidinecarboxamide

8009-6518 Screening compound: N~2~-[2-(1-naphthyloxy)ethyl]-1-(2-naphthylsulfonyl)-2-pyrrolidinecarboxamide
8009-6518 Screening compound: N~2~-[2-(1-naphthyloxy)ethyl]-1-(2-naphthylsulfonyl)-2-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-6518
N~2~-[2-(1-naphthyloxy)ethyl]-1-(2-naphthylsulfonyl)-2-pyrrolidinecarboxamide

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

8009-6518

Molecular Formula

C27H26N2O4S (C27 H26 N2 O4 S)

Compound Name

N~2~-[2-(1-naphthyloxy)ethyl]-1-(2-naphthylsulfonyl)-2-pyrrolidinecarboxamide

IUPAC name

N-[2-(naphthalen-1-yloxy)ethyl]-1-(naphthalene-2-sulfonyl)pyrrolidine-2-carboxamide

SMILES

O=C(C(CCC1)N1S(c1cc2ccccc2cc1)(=O)=O)NCCOc1cccc2ccccc12

InChI

InChI=1S/C27H26N2O4S/c30-27(28-16-18-33-26-13-5-10-21-8-3-4-11-24(21)26)25-12-6-17-29(25)34(31,32)23-15-14-20-7-1-2-9-22(20)19-23/h1-5,7-11,13-15,19,25H,6,12,16-18H2,(H,28,30)/t25-/m0/s1

InChI Key

HNBJSUISSMKILL-VWLOTQADSA-N

MDL Number (MFCD)

MFCD01797429

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.408

Distribution Coefficient, logD

5.408

Water Solubility, LogSw

-6.86

Polar Surface Area

64.002

Acid Dissociation Constant (pKa)

13.51

Base Dissociation Constant (pKb)

-1.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.22

8009-6518 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 8009-6518 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-6518?
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What is the minimum amount of 8009-6518 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-6518
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-6518
  • 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 8009-6518 available by request