V026-4205 Screening compound: N-(butan-2-yl)-N-(2-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}ethyl)heptanamide

V026-4205 Screening compound: N-(butan-2-yl)-N-(2-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}ethyl)heptanamide
V026-4205 Screening compound: N-(butan-2-yl)-N-(2-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}ethyl)heptanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-4205
N-(butan-2-yl)-N-(2-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}ethyl)heptanamide

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

V026-4205

Molecular Formula

C22H31ClN4O2S (C22 H31 ClN4 O2 S)

Compound Name

N-(butan-2-yl)-N-(2-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}ethyl)heptanamide

IUPAC name

N-(butan-2-yl)-N-(2-{[5-(3-chlorophenyl)-134-thiadiazol-2-yl]carbamoyl}ethyl)heptanamide

SMILES

CCCCCCC(N(CCC(Nc1nnc(-c2cccc(Cl)c2)s1)=O)C(C)CC)=O

InChI

InChI=1S/C22H31ClN4O2S/c1-4-6-7-8-12-20(29)27(16(3)5-2)14-13-19(28)24-22-26-25-21(30-22)17-10-9-11-18(23)15-17/h9-11,15-16H,4-8,12-14H2,1-3H3,(H,24,26,28)/t16-/m0/s1

InChI Key

DDRWPGUECIWOAN-INIZCTEOSA-N

MDL Number (MFCD)

MFCD19716742

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

451.03

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.326

Distribution Coefficient, logD

6.325

Water Solubility, LogSw

-6.04

Polar Surface Area

61.923

Acid Dissociation Constant (pKa)

10.55

Base Dissociation Constant (pKb)

5.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

54.50

References: we are preparing a list of scientific research reports with V026-4205 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-4205?
Check Price and Availability of V026-4205, 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 V026-4205 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-4205
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-4205
  • 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 V026-4205 available by request