3272-1038 Screening compound: methyl 4-[(E)-{[2-(pyridin-2-ylsulfanyl)propanamido]imino}methyl]benzoate

3272-1038 Screening compound: methyl 4-[(E)-{[2-(pyridin-2-ylsulfanyl)propanamido]imino}methyl]benzoate
3272-1038 Screening compound: methyl 4-[(E)-{[2-(pyridin-2-ylsulfanyl)propanamido]imino}methyl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3272-1038
methyl 4-[(E)-{[2-(pyridin-2-ylsulfanyl)propanamido]imino}methyl]benzoate

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

3272-1038

Molecular Formula

C17H17N3O3S (C17 H17 N3 O3 S)

Compound Name

methyl 4-[(E)-{[2-(pyridin-2-ylsulfanyl)propanamido]imino}methyl]benzoate

IUPAC name

methyl 4-[(E)-{[2-(pyridin-2-ylsulfanyl)propanamido]imino}methyl]benzoate

SMILES

CC(C(N/N=C/c(cc1)ccc1C(OC)=O)=O)Sc1ncccc1

InChI

InChI=1S/C17H17N3O3S/c1-12(24-15-5-3-4-10-18-15)16(21)20-19-11-13-6-8-14(9-7-13)17(22)23-2/h3-12H,1-2H3,(H,20,21)/t12-/m0/s1

InChI Key

LZFNSRAANWDXEU-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD02109629

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.148

Distribution Coefficient, logD

3.148

Water Solubility, LogSw

-3.35

Polar Surface Area

65.137

Acid Dissociation Constant (pKa)

10.39

Base Dissociation Constant (pKb)

2.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

17.60

References: we are preparing a list of scientific research reports with 3272-1038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3272-1038?
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What is the minimum amount of 3272-1038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3272-1038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3272-1038
  • 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 3272-1038 available by request