V028-0499 Screening compound: 4-(2-methylbenzoyl)-8-(3-nitrobenzoyl)-N-[(pyridin-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide

V028-0499 Screening compound: 4-(2-methylbenzoyl)-8-(3-nitrobenzoyl)-N-[(pyridin-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
V028-0499 Screening compound: 4-(2-methylbenzoyl)-8-(3-nitrobenzoyl)-N-[(pyridin-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-0499
4-(2-methylbenzoyl)-8-(3-nitrobenzoyl)-N-[(pyridin-2-yl)methyl]-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

V028-0499

Molecular Formula

C29H29N5O6 (C29 H29 N5 O6)

Compound Name

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

IUPAC name

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

SMILES

Cc(cccc1)c1C(N1C(CC2)(CCN2C(c2cccc([N+]([O-])=O)c2)=O)OCC1C(NCc1ncccc1)=O)=O

InChI

InChI=1S/C29H29N5O6/c1-20-7-2-3-11-24(20)28(37)33-25(26(35)31-18-22-9-4-5-14-30-22)19-40-29(33)12-15-32(16-13-29)27(36)21-8-6-10-23(17-21)34(38)39/h2-11,14,17,25H,12-13,15-16,18-19H2,1H3,(H,31,35)/t25-/m1/s1

InChI Key

UDZJWJJIAGUFAW-RUZDIDTESA-N

MDL Number (MFCD)

MFCD19810686

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

543.58

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.162

Distribution Coefficient, logD

2.162

Water Solubility, LogSw

-2.81

Polar Surface Area

106.920

Acid Dissociation Constant (pKa)

12.82

Base Dissociation Constant (pKb)

4.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.00

References: we are preparing a list of scientific research reports with V028-0499 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-0499?
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What is the minimum amount of V028-0499 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-0499
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-0499
  • 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 V028-0499 available by request