D337-0715 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-N-[(furan-2-yl)methyl]-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide

D337-0715 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-N-[(furan-2-yl)methyl]-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
D337-0715 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-N-[(furan-2-yl)methyl]-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D337-0715
N-{[4-(dimethylamino)phenyl]methyl}-N-[(furan-2-yl)methyl]-5-(thiophen-2-yl)-1,2-oxazole-3-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

D337-0715

Molecular Formula

C22H21N3O3S (C22 H21 N3 O3 S)

Compound Name

N-{[4-(dimethylamino)phenyl]methyl}-N-[(furan-2-yl)methyl]-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide

IUPAC name

N-{[4-(dimethylamino)phenyl]methyl}-N-[(furan-2-yl)methyl]-5-(thiophen-2-yl)-12-oxazole-3-carboxamide

SMILES

CN(C)c1ccc(CN(Cc2ccco2)C(c2noc(-c3cccs3)c2)=O)cc1

InChI

InChI=1S/C22H21N3O3S/c1-24(2)17-9-7-16(8-10-17)14-25(15-18-5-3-11-27-18)22(26)19-13-20(28-23-19)21-6-4-12-29-21/h3-13H,14-15H2,1-2H3

InChI Key

YVFFWDRCYLDVCG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12916117

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.476

Distribution Coefficient, logD

4.461

Water Solubility, LogSw

-4.32

Polar Surface Area

49.285

Acid Dissociation Constant (pKa)

27.54

Base Dissociation Constant (pKb)

5.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

D337-0715 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D337-0715 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D337-0715?
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What is the minimum amount of D337-0715 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D337-0715
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D337-0715
  • 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 D337-0715 available by request