V011-1271 Screening compound: 2-[({2-[(3,4-dichlorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-1,3-benzothiazole

V011-1271 Screening compound: 2-[({2-[(3,4-dichlorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-1,3-benzothiazole
V011-1271 Screening compound: 2-[({2-[(3,4-dichlorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-1,3-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-1271
2-[({2-[(3,4-dichlorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-1,3-benzothiazole

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

V011-1271

Molecular Formula

C18H12Cl2N2S3 (C18 H12 Cl2 N2 S3)

Compound Name

2-[({2-[(3,4-dichlorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-1,3-benzothiazole

IUPAC name

2-[({2-[(34-dichlorophenyl)methyl]-13-thiazol-4-yl}methyl)sulfanyl]-13-benzothiazole

SMILES

Clc(ccc(Cc1nc(CSc2nc(cccc3)c3s2)cs1)c1)c1Cl

InChI

InChI=1S/C18H12Cl2N2S3/c19-13-6-5-11(7-14(13)20)8-17-21-12(9-23-17)10-24-18-22-15-3-1-2-4-16(15)25-18/h1-7,9H,8,10H2

InChI Key

IKLYEAJROVMTSU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19945208

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

7.350

Distribution Coefficient, logD

7.350

Water Solubility, LogSw

-6.91

Polar Surface Area

19.773

Acid Dissociation Constant (pKa)

27.69

Base Dissociation Constant (pKb)

1.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

V011-1271 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V011-1271 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-1271?
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What is the minimum amount of V011-1271 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-1271
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-1271
  • 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 V011-1271 available by request