V011-8229 Screening compound: methyl 5-[4-({5-[(3-methoxyphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)-1,4-diazepan-1-yl]-5-oxopentanoate

V011-8229 Screening compound: methyl 5-[4-({5-[(3-methoxyphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)-1,4-diazepan-1-yl]-5-oxopentanoate
V011-8229 Screening compound: methyl 5-[4-({5-[(3-methoxyphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)-1,4-diazepan-1-yl]-5-oxopentanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-8229
methyl 5-[4-({5-[(3-methoxyphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)-1,4-diazepan-1-yl]-5-oxopentanoate

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

V011-8229

Molecular Formula

C25H32N2O7 (C25 H32 N2 O7)

Compound Name

methyl 5-[4-({5-[(3-methoxyphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)-1,4-diazepan-1-yl]-5-oxopentanoate

IUPAC name

methyl 5-[4-({5-[(3-methoxyphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)-14-diazepan-1-yl]-5-oxopentanoate

SMILES

COC(CCCC(N1CCN(CC(OC=C2OCc3cc(OC)ccc3)=CC2=O)CCC1)=O)=O

InChI

InChI=1S/C25H32N2O7/c1-31-20-7-3-6-19(14-20)17-34-23-18-33-21(15-22(23)28)16-26-10-5-11-27(13-12-26)24(29)8-4-9-25(30)32-2/h3,6-7,14-15,18H,4-5,8-13,16-17H2,1-2H3

InChI Key

VAQJDIPQQDWAEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19966115

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

472.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.529

Distribution Coefficient, logD

1.507

Water Solubility, LogSw

-1.80

Polar Surface Area

78.537

Acid Dissociation Constant (pKa)

22.30

Base Dissociation Constant (pKb)

6.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.00

References: we are preparing a list of scientific research reports with V011-8229 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-8229?
Check Price and Availability of V011-8229, 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 V011-8229 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-8229
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-8229
  • 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 V011-8229 available by request