V007-3566 Screening compound: 2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole

V007-3566 Screening compound: 2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole
V007-3566 Screening compound: 2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-3566
2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole

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

V007-3566

Molecular Formula

C23H25ClFN3O4S2 (C23 H25 ClFN3 O4 S2)

Compound Name

2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-1,3-benzodiazole

IUPAC name

2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-13-benzodiazole

SMILES

O=S(c(cc1)cc2c1n(CC1OCCC1)c(SCc(c(F)ccc1)c1Cl)n2)(N1CCOCC1)=O

InChI

InChI=1S/C23H25ClFN3O4S2/c24-19-4-1-5-20(25)18(19)15-33-23-26-21-13-17(34(29,30)27-8-11-31-12-9-27)6-7-22(21)28(23)14-16-3-2-10-32-16/h1,4-7,13,16H,2-3,8-12,14-15H2/t16-/m1/s1

InChI Key

YMCZCYYNBUJLAK-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD19958405

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

526.05

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.369

Distribution Coefficient, logD

4.369

Water Solubility, LogSw

-4.44

Polar Surface Area

58.751

Acid Dissociation Constant (pKa)

24.27

Base Dissociation Constant (pKb)

3.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.50

References: we are preparing a list of scientific research reports with V007-3566 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-3566?
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What is the minimum amount of V007-3566 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-3566
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-3566
  • 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 V007-3566 available by request