V009-7031 Screening compound: N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-methoxy-N-(propan-2-yl)benzamide

V009-7031 Screening compound: N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-methoxy-N-(propan-2-yl)benzamide
V009-7031 Screening compound: N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-methoxy-N-(propan-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-7031
N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-methoxy-N-(propan-2-yl)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

V009-7031

Molecular Formula

C28H31ClN2O4S (C28 H31 ClN2 O4 S)

Compound Name

N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-methoxy-N-(propan-2-yl)benzamide

IUPAC name

N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)-3-methoxy-N-(propan-2-yl)benzamide

SMILES

CC(C)N(CC(N(CC1)C(COc(cc2)cc(C)c2Cl)c2c1scc2)=O)C(c1cc(OC)ccc1)=O

InChI

InChI=1S/C28H31ClN2O4S/c1-18(2)31(28(33)20-6-5-7-21(15-20)34-4)16-27(32)30-12-10-26-23(11-13-36-26)25(30)17-35-22-8-9-24(29)19(3)14-22/h5-9,11,13-15,18,25H,10,12,16-17H2,1-4H3/t25-/m0/s1

InChI Key

SXXPNXGQMDRGGY-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19865027

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

527.08

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.198

Distribution Coefficient, logD

6.198

Water Solubility, LogSw

-6.27

Polar Surface Area

47.574

Acid Dissociation Constant (pKa)

22.83

Base Dissociation Constant (pKb)

0.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with V009-7031 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of V009-7031 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-7031
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-7031
  • 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 V009-7031 available by request