SD06-0819 Screening compound: (1R,2R,4R)-N~1~-(2-furylmethyl)-2-[(2-methoxyacetyl)amino]-4-(phenoxymethyl)cyclopentane-1-carboxamide

SD06-0819 Screening compound: (1R,2R,4R)-N~1~-(2-furylmethyl)-2-[(2-methoxyacetyl)amino]-4-(phenoxymethyl)cyclopentane-1-carboxamide
SD06-0819 Screening compound: (1R,2R,4R)-N~1~-(2-furylmethyl)-2-[(2-methoxyacetyl)amino]-4-(phenoxymethyl)cyclopentane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SD06-0819
(1R,2R,4R)-N~1~-(2-furylmethyl)-2-[(2-methoxyacetyl)amino]-4-(phenoxymethyl)cyclopentane-1-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

SD06-0819

Molecular Formula

C21H26N2O5 (C21 H26 N2 O5)

Compound Name

(1R,2R,4R)-N~1~-(2-furylmethyl)-2-[(2-methoxyacetyl)amino]-4-(phenoxymethyl)cyclopentane-1-carboxamide

IUPAC name

(1R2R4R)-N-[(furan-2-yl)methyl]-2-(2-methoxyacetamido)-4-(phenoxymethyl)cyclopentane-1-carboxamide

SMILES

COCC(N[C@@H](C[C@@H](COc1ccccc1)C1)[C@H]1C(NCc1ccco1)=O)=O

InChI

InChI=1S/C21H26N2O5/c1-26-14-20(24)23-19-11-15(13-28-16-6-3-2-4-7-16)10-18(19)21(25)22-12-17-8-5-9-27-17/h2-9,15,18-19H,10-14H2,1H3,(H,22,25)(H,23,24)/t15-,18+,19+/m1/s1

InChI Key

TVLVTUGPPQFDIW-MNEFBYGVSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.268

Distribution Coefficient, logD

2.268

Water Solubility, LogSw

-2.76

Polar Surface Area

73.005

Acid Dissociation Constant (pKa)

12.11

Base Dissociation Constant (pKb)

0.71

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

42.86

SD06-0819 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SD06-0819 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD06-0819?
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What is the minimum amount of SD06-0819 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD06-0819
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD06-0819
  • 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 SD06-0819 available by request