V020-0280 Screening compound: 2,4-dichloro-N-{[1-(2-methoxyethyl)-2-[(3-methoxyphenyl)methanesulfonyl]-1H-imidazol-5-yl]methyl}-N-[(oxolan-2-yl)methyl]benzamide

V020-0280 Screening compound: 2,4-dichloro-N-{[1-(2-methoxyethyl)-2-[(3-methoxyphenyl)methanesulfonyl]-1H-imidazol-5-yl]methyl}-N-[(oxolan-2-yl)methyl]benzamide
V020-0280 Screening compound: 2,4-dichloro-N-{[1-(2-methoxyethyl)-2-[(3-methoxyphenyl)methanesulfonyl]-1H-imidazol-5-yl]methyl}-N-[(oxolan-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-0280
2,4-dichloro-N-{[1-(2-methoxyethyl)-2-[(3-methoxyphenyl)methanesulfonyl]-1H-imidazol-5-yl]methyl}-N-[(oxolan-2-yl)methyl]benzamide

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

V020-0280

Molecular Formula

C27H31Cl2N3O6S (C27 H31 Cl2 N3 O6 S)

Compound Name

2,4-dichloro-N-{[1-(2-methoxyethyl)-2-[(3-methoxyphenyl)methanesulfonyl]-1H-imidazol-5-yl]methyl}-N-[(oxolan-2-yl)methyl]benzamide

IUPAC name

24-dichloro-N-{[1-(2-methoxyethyl)-2-[(3-methoxyphenyl)methanesulfonyl]-1H-imidazol-5-yl]methyl}-N-[(oxolan-2-yl)methyl]benzamide

SMILES

COCCn1c(S(Cc2cc(OC)ccc2)(=O)=O)ncc1CN(CC1OCCC1)C(c(ccc(Cl)c1)c1Cl)=O

InChI

InChI=1S/C27H31Cl2N3O6S/c1-36-12-10-32-21(15-30-27(32)39(34,35)18-19-5-3-6-22(13-19)37-2)16-31(17-23-7-4-11-38-23)26(33)24-9-8-20(28)14-25(24)29/h3,5-6,8-9,13-15,23H,4,7,10-12,16-18H2,1-2H3/t23-/m1/s1

InChI Key

QHFCLTVFXFEVPH-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD19818888

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

596.53

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.686

Distribution Coefficient, logD

3.686

Water Solubility, LogSw

-4.12

Polar Surface Area

81.382

Acid Dissociation Constant (pKa)

20.02

Base Dissociation Constant (pKb)

-3.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.70

V020-0280 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V020-0280 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-0280?
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What is the minimum amount of V020-0280 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-0280
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-0280
  • 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 V020-0280 available by request