L397-0707 Screening compound: N~1~-(3-acetylphenyl)-2-[4-(2-furylmethyl)-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl]acetamide

L397-0707 Screening compound: N~1~-(3-acetylphenyl)-2-[4-(2-furylmethyl)-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl]acetamide
L397-0707 Screening compound: N~1~-(3-acetylphenyl)-2-[4-(2-furylmethyl)-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L397-0707
N~1~-(3-acetylphenyl)-2-[4-(2-furylmethyl)-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl]acetamide

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

L397-0707

Molecular Formula

C22H17N5O5S (C22 H17 N5 O5 S)

Compound Name

N~1~-(3-acetylphenyl)-2-[4-(2-furylmethyl)-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl]acetamide

IUPAC name

N-(3-acetylphenyl)-2-{8-[(furan-2-yl)methyl]-712-dioxo-5-thia-181011-tetraazatricyclo[7.3.0.0^{26}]dodeca-2(6)39-trien-11-yl}acetamide

SMILES

CC(c1cccc(NC(CN(C(N2c3c4scc3)=O)N=C2N(Cc2ccco2)C4=O)=O)c1)=O

InChI

InChI=1S/C22H17N5O5S/c1-13(28)14-4-2-5-15(10-14)23-18(29)12-26-22(31)27-17-7-9-33-19(17)20(30)25(21(27)24-26)11-16-6-3-8-32-16/h2-10H,11-12H2,1H3,(H,23,29)

InChI Key

PINZJVFRUJNWSS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27251323

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.47

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.622

Distribution Coefficient, logD

2.622

Water Solubility, LogSw

-3.05

Polar Surface Area

93.679

Acid Dissociation Constant (pKa)

11.52

Base Dissociation Constant (pKb)

0.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

L397-0707 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with L397-0707 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L397-0707?
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What is the minimum amount of L397-0707 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L397-0707
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L397-0707
  • 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 L397-0707 available by request