V029-4769 Screening compound: propan-2-yl 2-[(4-{[(ethylcarbamoyl)(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate

V029-4769 Screening compound: propan-2-yl 2-[(4-{[(ethylcarbamoyl)(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate
V029-4769 Screening compound: propan-2-yl 2-[(4-{[(ethylcarbamoyl)(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-4769
propan-2-yl 2-[(4-{[(ethylcarbamoyl)(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate

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

V029-4769

Molecular Formula

C23H30N2O7S (C23 H30 N2 O7 S)

Compound Name

propan-2-yl 2-[(4-{[(ethylcarbamoyl)(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate

IUPAC name

propan-2-yl 2-[(4-{[(ethylcarbamoyl)(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate

SMILES

CCNC(N(CCOC)Cc(cc1)ccc1OS(c(cccc1)c1C(OC(C)C)=O)(=O)=O)=O

InChI

InChI=1S/C23H30N2O7S/c1-5-24-23(27)25(14-15-30-4)16-18-10-12-19(13-11-18)32-33(28,29)21-9-7-6-8-20(21)22(26)31-17(2)3/h6-13,17H,5,14-16H2,1-4H3,(H,24,27)

InChI Key

ZTVNPEJZNFRMJZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20498929

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.57

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.883

Distribution Coefficient, logD

2.883

Water Solubility, LogSw

-3.54

Polar Surface Area

91.005

Acid Dissociation Constant (pKa)

16.86

Base Dissociation Constant (pKb)

1.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

References: we are preparing a list of scientific research reports with V029-4769 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-4769?
Check Price and Availability of V029-4769, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V029-4769 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-4769
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-4769
  • 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 V029-4769 available by request