G370-0012 Screening compound: N-{4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide

G370-0012 Screening compound: N-{4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
G370-0012 Screening compound: N-{4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G370-0012
N-{4-[4-(3-chlorophenyl)piperazine-1-carbonyl]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

G370-0012

Molecular Formula

C22H22ClN3O3S (C22 H22 ClN3 O3 S)

Compound Name

N-{4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide

IUPAC name

N-{4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl}-56-dihydro-14-oxathiine-2-carboxamide

SMILES

O=C(C1=CSCCO1)Nc(cc1)ccc1C(N(CC1)CCN1c1cccc(Cl)c1)=O

InChI

InChI=1S/C22H22ClN3O3S/c23-17-2-1-3-19(14-17)25-8-10-26(11-9-25)22(28)16-4-6-18(7-5-16)24-21(27)20-15-30-13-12-29-20/h1-7,14-15H,8-13H2,(H,24,27)

InChI Key

LYTKPZJAEVKAND-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15004630

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.95

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.999

Distribution Coefficient, logD

2.835

Water Solubility, LogSw

-3.78

Polar Surface Area

52.867

Acid Dissociation Constant (pKa)

7.74

Base Dissociation Constant (pKb)

2.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with G370-0012 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G370-0012?
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What is the minimum amount of G370-0012 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G370-0012
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G370-0012
  • 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 G370-0012 available by request