V003-2673 Screening compound: 2-{[(2,3-dimethoxyphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-[(3-methylpiperidin-1-yl)sulfonyl]-1H-1,3-benzodiazole

V003-2673 Screening compound: 2-{[(2,3-dimethoxyphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-[(3-methylpiperidin-1-yl)sulfonyl]-1H-1,3-benzodiazole
V003-2673 Screening compound: 2-{[(2,3-dimethoxyphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-[(3-methylpiperidin-1-yl)sulfonyl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-2673
2-{[(2,3-dimethoxyphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-[(3-methylpiperidin-1-yl)sulfonyl]-1H-1,3-benzodiazole

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

V003-2673

Molecular Formula

C27H37N3O5S2 (C27 H37 N3 O5 S2)

Compound Name

2-{[(2,3-dimethoxyphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-[(3-methylpiperidin-1-yl)sulfonyl]-1H-1,3-benzodiazole

IUPAC name

2-{[(23-dimethoxyphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-[(3-methylpiperidin-1-yl)sulfonyl]-1H-13-benzodiazole

SMILES

CCOCCCn1c(SCc(cccc2OC)c2OC)nc2c1ccc(S(N1CC(C)CCC1)(=O)=O)c2

InChI

InChI=1S/C27H37N3O5S2/c1-5-35-16-8-15-30-24-13-12-22(37(31,32)29-14-7-9-20(2)18-29)17-23(24)28-27(30)36-19-21-10-6-11-25(33-3)26(21)34-4/h6,10-13,17,20H,5,7-9,14-16,18-19H2,1-4H3/t20-/m0/s1

InChI Key

KPCBCRMWNPAUQD-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19960377

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

547.74

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.334

Distribution Coefficient, logD

5.333

Water Solubility, LogSw

-5.31

Polar Surface Area

65.697

Acid Dissociation Constant (pKa)

24.63

Base Dissociation Constant (pKb)

4.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

51.90

References: we are preparing a list of scientific research reports with V003-2673 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-2673?
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What is the minimum amount of V003-2673 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-2673
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-2673
  • 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 V003-2673 available by request