V023-2636 Screening compound: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-chloro-3-nitrophenyl)formamido]-3-methylpentanamide

V023-2636 Screening compound: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-chloro-3-nitrophenyl)formamido]-3-methylpentanamide
V023-2636 Screening compound: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-chloro-3-nitrophenyl)formamido]-3-methylpentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-2636
N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-chloro-3-nitrophenyl)formamido]-3-methylpentanamide

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

V023-2636

Molecular Formula

C21H19BrClN5O4S (C21 H19 BrClN5 O4 S)

Compound Name

N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-chloro-3-nitrophenyl)formamido]-3-methylpentanamide

IUPAC name

N-[5-(4-bromophenyl)-134-thiadiazol-2-yl]-2-[(4-chloro-3-nitrophenyl)formamido]-3-methylpentanamide

SMILES

CCC(C)C(C(Nc1nnc(-c(cc2)ccc2Br)s1)=O)NC(c(cc1)cc([N+]([O-])=O)c1Cl)=O

InChI

InChI=1S/C21H19BrClN5O4S/c1-3-11(2)17(24-18(29)13-6-9-15(23)16(10-13)28(31)32)19(30)25-21-27-26-20(33-21)12-4-7-14(22)8-5-12/h4-11,17H,3H2,1-2H3,(H,24,29)(H,25,27,30)

InChI Key

XBPSNSFDNUXYMS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19733344

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

552.84

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.913

Distribution Coefficient, logD

5.913

Water Solubility, LogSw

-6.17

Polar Surface Area

103.721

Acid Dissociation Constant (pKa)

10.50

Base Dissociation Constant (pKb)

-3.82

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with V023-2636 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-2636?
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What is the minimum amount of V023-2636 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-2636
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-2636
  • 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 V023-2636 available by request