V008-6741 Screening compound: N-(3-methoxypropyl)-N-{2-[4-(4-methylphenyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl}-4-(trifluoromethyl)benzamide

V008-6741 Screening compound: N-(3-methoxypropyl)-N-{2-[4-(4-methylphenyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl}-4-(trifluoromethyl)benzamide
V008-6741 Screening compound: N-(3-methoxypropyl)-N-{2-[4-(4-methylphenyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl}-4-(trifluoromethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-6741
N-(3-methoxypropyl)-N-{2-[4-(4-methylphenyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl}-4-(trifluoromethyl)benzamide

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

V008-6741

Molecular Formula

C28H29F3N2O3S (C28 H29 F3 N2 O3 S)

Compound Name

N-(3-methoxypropyl)-N-{2-[4-(4-methylphenyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl}-4-(trifluoromethyl)benzamide

IUPAC name

N-(3-methoxypropyl)-N-{2-[4-(4-methylphenyl)-4H5H6H7H-thieno[32-c]pyridin-5-yl]-2-oxoethyl}-4-(trifluoromethyl)benzamide

SMILES

Cc1ccc(C(c2c(CC3)scc2)N3C(CN(CCCOC)C(c2ccc(C(F)(F)F)cc2)=O)=O)cc1

InChI

InChI=1S/C28H29F3N2O3S/c1-19-4-6-20(7-5-19)26-23-13-17-37-24(23)12-15-33(26)25(34)18-32(14-3-16-36-2)27(35)21-8-10-22(11-9-21)28(29,30)31/h4-11,13,17,26H,3,12,14-16,18H2,1-2H3/t26-/m1/s1

InChI Key

HNZLHEDRWQSMTQ-AREMUKBSSA-N

MDL Number (MFCD)

MFCD19753325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

530.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.558

Distribution Coefficient, logD

5.558

Water Solubility, LogSw

-5.34

Polar Surface Area

41.156

Acid Dissociation Constant (pKa)

22.17

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

V008-6741 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V008-6741 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-6741?
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What is the minimum amount of V008-6741 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-6741
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-6741
  • 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 V008-6741 available by request