V029-6674 Screening compound: 4-{[N-(2-methoxyethyl)-3,3-dimethylbutanamido]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate

V029-6674 Screening compound: 4-{[N-(2-methoxyethyl)-3,3-dimethylbutanamido]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
V029-6674 Screening compound: 4-{[N-(2-methoxyethyl)-3,3-dimethylbutanamido]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-6674
4-{[N-(2-methoxyethyl)-3,3-dimethylbutanamido]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate

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

V029-6674

Molecular Formula

C23H30ClNO5S (C23 H30 ClNO5 S)

Compound Name

4-{[N-(2-methoxyethyl)-3,3-dimethylbutanamido]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate

IUPAC name

4-{[N-(2-methoxyethyl)-33-dimethylbutanamido]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate

SMILES

CC(C)(C)CC(N(CCOC)Cc(cc1)ccc1OS(c(c(C)ccc1)c1Cl)(=O)=O)=O

InChI

InChI=1S/C23H30ClNO5S/c1-17-7-6-8-20(24)22(17)31(27,28)30-19-11-9-18(10-12-19)16-25(13-14-29-5)21(26)15-23(2,3)4/h6-12H,13-16H2,1-5H3

InChI Key

GCOPYGZBYBNEBN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20498523

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.01

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.681

Distribution Coefficient, logD

4.681

Water Solubility, LogSw

-4.67

Polar Surface Area

60.276

Acid Dissociation Constant (pKa)

26.73

Base Dissociation Constant (pKb)

-2.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

References: we are preparing a list of scientific research reports with V029-6674 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-6674?
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What is the minimum amount of V029-6674 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-6674
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-6674
  • 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 V029-6674 available by request