S696-1522 Screening compound: ethyl 3-{[(3-{[5-methyl-2-(4-pyridyl)-1H-imidazol-1-yl]methyl}-1-azetanyl)carbonyl]amino}propanoate

S696-1522 Screening compound: ethyl 3-{[(3-{[5-methyl-2-(4-pyridyl)-1H-imidazol-1-yl]methyl}-1-azetanyl)carbonyl]amino}propanoate
S696-1522 Screening compound: ethyl 3-{[(3-{[5-methyl-2-(4-pyridyl)-1H-imidazol-1-yl]methyl}-1-azetanyl)carbonyl]amino}propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound S696-1522
ethyl 3-{[(3-{[5-methyl-2-(4-pyridyl)-1H-imidazol-1-yl]methyl}-1-azetanyl)carbonyl]amino}propanoate

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

S696-1522

Molecular Formula

C19H25N5O3 (C19 H25 N5 O3)

Compound Name

ethyl 3-{[(3-{[5-methyl-2-(4-pyridyl)-1H-imidazol-1-yl]methyl}-1-azetanyl)carbonyl]amino}propanoate

IUPAC name

n/a

SMILES

CCOC(CCNC(N1CC(Cn2c(-c3ccncc3)ncc2C)C1)=O)=O

InChI

InChI=1S/C19H25N5O3/c1-3-27-17(25)6-9-21-19(26)23-11-15(12-23)13-24-14(2)10-22-18(24)16-4-7-20-8-5-16/h4-5,7-8,10,15H,3,6,9,11-13H2,1-2H3,(H,21,26)

InChI Key

PJLDYBZODBFBID-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.527

Distribution Coefficient, logD

1.524

Water Solubility, LogSw

-1.35

Polar Surface Area

67.841

Acid Dissociation Constant (pKa)

16.11

Base Dissociation Constant (pKb)

5.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.40

References: we are preparing a list of scientific research reports with S696-1522 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S696-1522?
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What is the minimum amount of S696-1522 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S696-1522
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S696-1522
  • 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 S696-1522 available by request