V031-1858 Screening compound: 4-(3-fluorobenzoyl)-8-(2-methylbenzoyl)-3-(morpholine-4-carbonyl)-1-oxa-4,8-diazaspiro[4.5]decane

V031-1858 Screening compound: 4-(3-fluorobenzoyl)-8-(2-methylbenzoyl)-3-(morpholine-4-carbonyl)-1-oxa-4,8-diazaspiro[4.5]decane
V031-1858 Screening compound: 4-(3-fluorobenzoyl)-8-(2-methylbenzoyl)-3-(morpholine-4-carbonyl)-1-oxa-4,8-diazaspiro[4.5]decane alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-1858
4-(3-fluorobenzoyl)-8-(2-methylbenzoyl)-3-(morpholine-4-carbonyl)-1-oxa-4,8-diazaspiro[4.5]decane

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

V031-1858

Molecular Formula

C27H30FN3O5 (C27 H30 FN3 O5)

Compound Name

4-(3-fluorobenzoyl)-8-(2-methylbenzoyl)-3-(morpholine-4-carbonyl)-1-oxa-4,8-diazaspiro[4.5]decane

IUPAC name

4-(3-fluorobenzoyl)-8-(2-methylbenzoyl)-3-(morpholine-4-carbonyl)-1-oxa-48-diazaspiro[4.5]decane

SMILES

Cc(cccc1)c1C(N(CC1)CCC11OCC(C(N2CCOCC2)=O)N1C(c1cccc(F)c1)=O)=O

InChI

InChI=1S/C27H30FN3O5/c1-19-5-2-3-8-22(19)25(33)29-11-9-27(10-12-29)31(24(32)20-6-4-7-21(28)17-20)23(18-36-27)26(34)30-13-15-35-16-14-30/h2-8,17,23H,9-16,18H2,1H3/t23-/m0/s1

InChI Key

CKUTYCSCGJXITO-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19774433

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.743

Distribution Coefficient, logD

1.743

Water Solubility, LogSw

-2.34

Polar Surface Area

64.139

Acid Dissociation Constant (pKa)

19.90

Base Dissociation Constant (pKb)

-1.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.40

References: we are preparing a list of scientific research reports with V031-1858 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-1858?
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What is the minimum amount of V031-1858 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-1858
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-1858
  • 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 V031-1858 available by request