G207-0082 Screening compound: 1-[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-N~4~-(1,2,3,4-tetrahydro-1-naphthalenyl)-4-piperidinecarboxamide

G207-0082 Screening compound: 1-[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-N~4~-(1,2,3,4-tetrahydro-1-naphthalenyl)-4-piperidinecarboxamide
G207-0082 Screening compound: 1-[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-N~4~-(1,2,3,4-tetrahydro-1-naphthalenyl)-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G207-0082
1-[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-N~4~-(1,2,3,4-tetrahydro-1-naphthalenyl)-4-piperidinecarboxamide

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

G207-0082

Molecular Formula

C28H33N3O3S (C28 H33 N3 O3 S)

Compound Name

1-[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-N~4~-(1,2,3,4-tetrahydro-1-naphthalenyl)-4-piperidinecarboxamide

IUPAC name

1-[5-(34-dimethylphenyl)-4-methyl-11-dioxo-1lambda62-thiazol-3-yl]-N-(1234-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide

SMILES

CC(C(N(CC1)CCC1C(NC(CCC1)c2c1cccc2)=O)=N1)=C(c2cc(C)c(C)cc2)S1(=O)=O

InChI

InChI=1S/C28H33N3O3S/c1-18-11-12-23(17-19(18)2)26-20(3)27(30-35(26,33)34)31-15-13-22(14-16-31)28(32)29-25-10-6-8-21-7-4-5-9-24(21)25/h4-5,7,9,11-12,17,22,25H,6,8,10,13-16H2,1-3H3,(H,29,32)/t25-/m0/s1

InChI Key

VVPWRSGPLKMNNM-VWLOTQADSA-N

MDL Number (MFCD)

MFCD14985930

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.65

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.885

Distribution Coefficient, logD

4.885

Water Solubility, LogSw

-4.53

Polar Surface Area

67.387

Acid Dissociation Constant (pKa)

11.58

Base Dissociation Constant (pKb)

-0.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with G207-0082 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G207-0082?
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What is the minimum amount of G207-0082 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G207-0082
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G207-0082
  • 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 G207-0082 available by request