V005-7156 Screening compound: ethyl 2-{[5-(3,4-dimethoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}pentanoate

V005-7156 Screening compound: ethyl 2-{[5-(3,4-dimethoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}pentanoate
V005-7156 Screening compound: ethyl 2-{[5-(3,4-dimethoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}pentanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-7156
ethyl 2-{[5-(3,4-dimethoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}pentanoate

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

V005-7156

Molecular Formula

C24H29N3O4S (C24 H29 N3 O4 S)

Compound Name

ethyl 2-{[5-(3,4-dimethoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}pentanoate

IUPAC name

ethyl 2-{[5-(34-dimethoxyphenyl)-4-(4-methylphenyl)-4H-124-triazol-3-yl]sulfanyl}pentanoate

SMILES

CCCC(C(OCC)=O)Sc1nnc(-c(cc2)cc(OC)c2OC)n1-c1ccc(C)cc1

InChI

InChI=1S/C24H29N3O4S/c1-6-8-21(23(28)31-7-2)32-24-26-25-22(27(24)18-12-9-16(3)10-13-18)17-11-14-19(29-4)20(15-17)30-5/h9-15,21H,6-8H2,1-5H3/t21-/m0/s1

InChI Key

XVUABYHFXBHKLQ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19843452

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

455.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.569

Distribution Coefficient, logD

5.569

Water Solubility, LogSw

-5.40

Polar Surface Area

60.999

Acid Dissociation Constant (pKa)

17.67

Base Dissociation Constant (pKb)

4.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with V005-7156 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-7156?
Check Price and Availability of V005-7156, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V005-7156 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-7156
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-7156
  • 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 V005-7156 available by request