V026-4191 Screening compound: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3-{N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethylphenyl)formamido}propanamide

V026-4191 Screening compound: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3-{N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethylphenyl)formamido}propanamide
V026-4191 Screening compound: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3-{N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethylphenyl)formamido}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-4191
N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3-{N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethylphenyl)formamido}propanamide

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

V026-4191

Molecular Formula

C30H31ClN4O4S (C30 H31 ClN4 O4 S)

Compound Name

N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3-{N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethylphenyl)formamido}propanamide

IUPAC name

N-[5-(4-chlorophenyl)-134-thiadiazol-2-yl]-3-{N-[2-(34-dimethoxyphenyl)ethyl]-1-(4-ethylphenyl)formamido}propanamide

SMILES

CCc(cc1)ccc1C(N(CCC(Nc1nnc(-c(cc2)ccc2Cl)s1)=O)CCc(cc1)cc(OC)c1OC)=O

InChI

InChI=1S/C30H31ClN4O4S/c1-4-20-5-8-23(9-6-20)29(37)35(17-15-21-7-14-25(38-2)26(19-21)39-3)18-16-27(36)32-30-34-33-28(40-30)22-10-12-24(31)13-11-22/h5-14,19H,4,15-18H2,1-3H3,(H,32,34,36)

InChI Key

JMBLOSCEMDOJHY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19714762

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

579.12

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.638

Distribution Coefficient, logD

5.638

Water Solubility, LogSw

-5.99

Polar Surface Area

77.818

Acid Dissociation Constant (pKa)

10.55

Base Dissociation Constant (pKb)

-2.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

V026-4191 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V026-4191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-4191?
Check Price and Availability of V026-4191, 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 V026-4191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-4191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-4191
  • 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 V026-4191 available by request