G370-0786 Screening compound: N-(2-{[(furan-2-yl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide

G370-0786 Screening compound: N-(2-{[(furan-2-yl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
G370-0786 Screening compound: N-(2-{[(furan-2-yl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G370-0786
N-(2-{[(furan-2-yl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-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

G370-0786

Molecular Formula

C17H16N2O4S (C17 H16 N2 O4 S)

Compound Name

N-(2-{[(furan-2-yl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide

IUPAC name

N-(2-{[(furan-2-yl)methyl]carbamoyl}phenyl)-56-dihydro-14-oxathiine-2-carboxamide

SMILES

O=C(c(cccc1)c1NC(C1=CSCCO1)=O)NCc1ccco1

InChI

InChI=1S/C17H16N2O4S/c20-16(18-10-12-4-3-7-22-12)13-5-1-2-6-14(13)19-17(21)15-11-24-9-8-23-15/h1-7,11H,8-10H2,(H,18,20)(H,19,21)

InChI Key

ZWALWKUHHWTYBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15004858

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.341

Distribution Coefficient, logD

2.200

Water Solubility, LogSw

-3.04

Polar Surface Area

64.423

Acid Dissociation Constant (pKa)

7.82

Base Dissociation Constant (pKb)

2.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

G370-0786 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G370-0786 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G370-0786?
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What is the minimum amount of G370-0786 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G370-0786
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G370-0786
  • 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 G370-0786 available by request