C760-0647 Screening compound: N-(3-chloro-2-methylphenyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

C760-0647 Screening compound: N-(3-chloro-2-methylphenyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
C760-0647 Screening compound: N-(3-chloro-2-methylphenyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C760-0647
N-(3-chloro-2-methylphenyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-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

C760-0647

Molecular Formula

C17H18ClNOS (C17 H18 ClNOS)

Compound Name

N-(3-chloro-2-methylphenyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

IUPAC name

N-(3-chloro-2-methylphenyl)-6-methyl-4567-tetrahydro-1-benzothiophene-3-carboxamide

SMILES

CC(CC1)Cc2c1c(C(Nc1cccc(Cl)c1C)=O)cs2

InChI

InChI=1S/C17H18ClNOS/c1-10-6-7-12-13(9-21-16(12)8-10)17(20)19-15-5-3-4-14(18)11(15)2/h3-5,9-10H,6-8H2,1-2H3,(H,19,20)/t10-/m1/s1

InChI Key

RVVWDPYHKBVBIX-SNVBAGLBSA-N

MDL Number (MFCD)

MFCD14791963

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.85

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.469

Distribution Coefficient, logD

5.467

Water Solubility, LogSw

-5.80

Polar Surface Area

23.571

Acid Dissociation Constant (pKa)

9.74

Base Dissociation Constant (pKb)

-2.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.30

References: we are preparing a list of scientific research reports with C760-0647 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C760-0647?
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What is the minimum amount of C760-0647 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C760-0647
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C760-0647
  • 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 C760-0647 available by request