V026-7955 Screening compound: 7-methyl-4-(2-methylbenzoyl)-N-(4-pyridylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

V026-7955 Screening compound: 7-methyl-4-(2-methylbenzoyl)-N-(4-pyridylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
V026-7955 Screening compound: 7-methyl-4-(2-methylbenzoyl)-N-(4-pyridylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-7955
7-methyl-4-(2-methylbenzoyl)-N-(4-pyridylmethyl)-1-oxa-4-azaspiro[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

V026-7955

Molecular Formula

C24H29N3O3 (C24 H29 N3 O3)

Compound Name

7-methyl-4-(2-methylbenzoyl)-N-(4-pyridylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

IUPAC name

7-methyl-4-(2-methylbenzoyl)-N-[(pyridin-4-yl)methyl]-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

SMILES

CC(CCC1)CC11OCC(C(NCc2ccncc2)=O)N1C(c1c(C)cccc1)=O

InChI

InChI=1S/C24H29N3O3/c1-17-6-5-11-24(14-17)27(23(29)20-8-4-3-7-18(20)2)21(16-30-24)22(28)26-15-19-9-12-25-13-10-19/h3-4,7-10,12-13,17,21H,5-6,11,14-16H2,1-2H3,(H,26,28)

InChI Key

OLUINMKGEBVEDD-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

407.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.928

Distribution Coefficient, logD

2.925

Water Solubility, LogSw

-3.26

Polar Surface Area

56.967

Acid Dissociation Constant (pKa)

13.45

Base Dissociation Constant (pKb)

5.29

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

45.83

V026-7955 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V026-7955 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-7955?
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What is the minimum amount of V026-7955 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-7955
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-7955
  • 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 V026-7955 available by request