G370-0792 Screening compound: N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide

G370-0792 Screening compound: N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
G370-0792 Screening compound: N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G370-0792
N-(2-{[(2H-1,3-benzodioxol-5-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

G370-0792

Molecular Formula

C20H18N2O5S (C20 H18 N2 O5 S)

Compound Name

N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide

IUPAC name

N-(2-{[(2H-13-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-56-dihydro-14-oxathiine-2-carboxamide

SMILES

O=C(c(cccc1)c1NC(C1=CSCCO1)=O)NCc(cc1)cc2c1OCO2

InChI

InChI=1S/C20H18N2O5S/c23-19(21-10-13-5-6-16-17(9-13)27-12-26-16)14-3-1-2-4-15(14)22-20(24)18-11-28-8-7-25-18/h1-6,9,11H,7-8,10,12H2,(H,21,23)(H,22,24)

InChI Key

HYUOKXBRJKKHIB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15004862

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.504

Distribution Coefficient, logD

2.363

Water Solubility, LogSw

-3.13

Polar Surface Area

73.789

Acid Dissociation Constant (pKa)

7.82

Base Dissociation Constant (pKb)

2.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

G370-0792 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 G370-0792 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G370-0792?
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What is the minimum amount of G370-0792 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G370-0792
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G370-0792
  • 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 G370-0792 available by request