V014-0317 Screening compound: 2-{3-[4-(2,5-dimethylfuran-3-carbonyl)piperazin-1-yl]-4-methoxybenzenesulfonyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

V014-0317 Screening compound: 2-{3-[4-(2,5-dimethylfuran-3-carbonyl)piperazin-1-yl]-4-methoxybenzenesulfonyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
V014-0317 Screening compound: 2-{3-[4-(2,5-dimethylfuran-3-carbonyl)piperazin-1-yl]-4-methoxybenzenesulfonyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-0317
2-{3-[4-(2,5-dimethylfuran-3-carbonyl)piperazin-1-yl]-4-methoxybenzenesulfonyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

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

V014-0317

Molecular Formula

C29H35N3O7S (C29 H35 N3 O7 S)

Compound Name

2-{3-[4-(2,5-dimethylfuran-3-carbonyl)piperazin-1-yl]-4-methoxybenzenesulfonyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

IUPAC name

2-{3-[4-(25-dimethylfuran-3-carbonyl)piperazin-1-yl]-4-methoxybenzenesulfonyl}-67-dimethoxy-1234-tetrahydroisoquinoline

SMILES

Cc1cc(C(N(CC2)CCN2c(cc(cc2)S(N(CC3)Cc(cc4OC)c3cc4OC)(=O)=O)c2OC)=O)c(C)o1

InChI

InChI=1S/C29H35N3O7S/c1-19-14-24(20(2)39-19)29(33)31-12-10-30(11-13-31)25-17-23(6-7-26(25)36-3)40(34,35)32-9-8-21-15-27(37-4)28(38-5)16-22(21)18-32/h6-7,14-17H,8-13,18H2,1-5H3

InChI Key

QBCUQXXXEXNFKM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19950820

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

569.68

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.890

Distribution Coefficient, logD

3.890

Water Solubility, LogSw

-3.96

Polar Surface Area

81.857

Acid Dissociation Constant (pKa)

25.79

Base Dissociation Constant (pKb)

4.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.40

References: we are preparing a list of scientific research reports with V014-0317 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-0317?
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What is the minimum amount of V014-0317 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-0317
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-0317
  • 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 V014-0317 available by request