V028-0463 Screening compound: N-(2-methoxyethyl)-4-(2-methylbenzoyl)-8-(3-nitrobenzoyl)-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide

V028-0463 Screening compound: N-(2-methoxyethyl)-4-(2-methylbenzoyl)-8-(3-nitrobenzoyl)-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
V028-0463 Screening compound: N-(2-methoxyethyl)-4-(2-methylbenzoyl)-8-(3-nitrobenzoyl)-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-0463
N-(2-methoxyethyl)-4-(2-methylbenzoyl)-8-(3-nitrobenzoyl)-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide

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

V028-0463

Molecular Formula

C26H30N4O7 (C26 H30 N4 O7)

Compound Name

N-(2-methoxyethyl)-4-(2-methylbenzoyl)-8-(3-nitrobenzoyl)-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide

IUPAC name

N-(2-methoxyethyl)-4-(2-methylbenzoyl)-8-(3-nitrobenzoyl)-1-oxa-48-diazaspiro[4.5]decane-3-carboxamide

SMILES

Cc(cccc1)c1C(N1C(CC2)(CCN2C(c2cccc([N+]([O-])=O)c2)=O)OCC1C(NCCOC)=O)=O

InChI

InChI=1S/C26H30N4O7/c1-18-6-3-4-9-21(18)25(33)29-22(23(31)27-12-15-36-2)17-37-26(29)10-13-28(14-11-26)24(32)19-7-5-8-20(16-19)30(34)35/h3-9,16,22H,10-15,17H2,1-2H3,(H,27,31)/t22-/m1/s1

InChI Key

PCZJBCJDNGEFQC-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD19806966

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

510.55

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

1.805

Distribution Coefficient, logD

1.805

Water Solubility, LogSw

-2.55

Polar Surface Area

105.832

Acid Dissociation Constant (pKa)

14.46

Base Dissociation Constant (pKb)

-0.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.30

References: we are preparing a list of scientific research reports with V028-0463 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-0463?
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What is the minimum amount of V028-0463 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-0463
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-0463
  • 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 V028-0463 available by request