G008-3149 Screening compound: N-[3-(1,2,3,4-tetrahydroisoquinolin-2-yl)propyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonamide

G008-3149 Screening compound: N-[3-(1,2,3,4-tetrahydroisoquinolin-2-yl)propyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonamide
G008-3149 Screening compound: N-[3-(1,2,3,4-tetrahydroisoquinolin-2-yl)propyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G008-3149
N-[3-(1,2,3,4-tetrahydroisoquinolin-2-yl)propyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonamide

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

G008-3149

Molecular Formula

C20H20F3N3O3S2 (C20 H20 F3 N3 O3 S2)

Compound Name

N-[3-(1,2,3,4-tetrahydroisoquinolin-2-yl)propyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonamide

IUPAC name

N-[3-(1234-tetrahydroisoquinolin-2-yl)propyl]-5-[5-(trifluoromethyl)-12-oxazol-3-yl]thiophene-2-sulfonamide

SMILES

O=S(c1ccc(-c2noc(C(F)(F)F)c2)s1)(NCCCN(CC1)Cc2c1cccc2)=O

InChI

InChI=1S/C20H20F3N3O3S2/c21-20(22,23)18-12-16(25-29-18)17-6-7-19(30-17)31(27,28)24-9-3-10-26-11-8-14-4-1-2-5-15(14)13-26/h1-2,4-7,12,24H,3,8-11,13H2

InChI Key

JPMSDQDEDMRVMS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14975653

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.611

Distribution Coefficient, logD

3.828

Water Solubility, LogSw

-4.31

Polar Surface Area

68.036

Acid Dissociation Constant (pKa)

10.15

Base Dissociation Constant (pKb)

8.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with G008-3149 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G008-3149?
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What is the minimum amount of G008-3149 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G008-3149
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G008-3149
  • 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 G008-3149 available by request