G395-1421 Screening compound: ethyl 2-[3-(6-{[(4-chlorophenyl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamido]propanoate

G395-1421 Screening compound: ethyl 2-[3-(6-{[(4-chlorophenyl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamido]propanoate
G395-1421 Screening compound: ethyl 2-[3-(6-{[(4-chlorophenyl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamido]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G395-1421
ethyl 2-[3-(6-{[(4-chlorophenyl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamido]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

G395-1421

Molecular Formula

C20H23ClN6O3 (C20 H23 ClN6 O3)

Compound Name

ethyl 2-[3-(6-{[(4-chlorophenyl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamido]propanoate

IUPAC name

ethyl 2-[3-(6-{[(4-chlorophenyl)methyl]amino}-[124]triazolo[43-b]pyridazin-3-yl)propanamido]propanoate

SMILES

CCOC(C(C)NC(CCc1nnc(cc2)n1nc2NCc(cc1)ccc1Cl)=O)=O

InChI

InChI=1S/C20H23ClN6O3/c1-3-30-20(29)13(2)23-19(28)11-10-18-25-24-17-9-8-16(26-27(17)18)22-12-14-4-6-15(21)7-5-14/h4-9,13H,3,10-12H2,1-2H3,(H,22,26)(H,23,28)/t13-/m0/s1

InChI Key

SKBMNNACWZPRRP-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD15008068

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.89

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.922

Distribution Coefficient, logD

1.922

Water Solubility, LogSw

-2.88

Polar Surface Area

88.835

Acid Dissociation Constant (pKa)

13.77

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with G395-1421 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G395-1421?
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What is the minimum amount of G395-1421 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G395-1421
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G395-1421
  • 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 G395-1421 available by request