G370-0235 Screening compound: N-(4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide

G370-0235 Screening compound: N-(4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
G370-0235 Screening compound: N-(4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G370-0235
N-(4-{[3-(4-methylpiperazin-1-yl)propyl]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

G370-0235

Molecular Formula

C20H28N4O3S (C20 H28 N4 O3 S)

Compound Name

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

IUPAC name

N-(4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}phenyl)-56-dihydro-14-oxathiine-2-carboxamide

SMILES

CN1CCN(CCCNC(c(cc2)ccc2NC(C2=CSCCO2)=O)=O)CC1

InChI

InChI=1S/C20H28N4O3S/c1-23-9-11-24(12-10-23)8-2-7-21-19(25)16-3-5-17(6-4-16)22-20(26)18-15-28-14-13-27-18/h3-6,15H,2,7-14H2,1H3,(H,21,25)(H,22,26)

InChI Key

NYZLBBSEDRXOSG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15004718

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.473

Distribution Coefficient, logD

-0.677

Water Solubility, LogSw

-2.13

Polar Surface Area

64.672

Acid Dissociation Constant (pKa)

7.74

Base Dissociation Constant (pKb)

8.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

G370-0235 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with G370-0235 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G370-0235?
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What is the minimum amount of G370-0235 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G370-0235
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G370-0235
  • 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 G370-0235 available by request