L386-0035 Screening compound: N~1~-(3,4-dimethoxyphenyl)-2-[3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide

L386-0035 Screening compound: N~1~-(3,4-dimethoxyphenyl)-2-[3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
L386-0035 Screening compound: N~1~-(3,4-dimethoxyphenyl)-2-[3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L386-0035
N~1~-(3,4-dimethoxyphenyl)-2-[3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-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

L386-0035

Molecular Formula

C17H15N5O4S (C17 H15 N5 O4 S)

Compound Name

N~1~-(3,4-dimethoxyphenyl)-2-[3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide

IUPAC name

N-(34-dimethoxyphenyl)-2-{5-oxo-12-thia-3468-tetraazatricyclo[7.3.0.0^{26}]dodeca-1(9)2710-tetraen-4-yl}acetamide

SMILES

COc(ccc(NC(CN1N=C(c(scc2)c2N=C2)N2C1=O)=O)c1)c1OC

InChI

InChI=1S/C17H15N5O4S/c1-25-12-4-3-10(7-13(12)26-2)19-14(23)8-22-17(24)21-9-18-11-5-6-27-15(11)16(21)20-22/h3-7,9H,8H2,1-2H3,(H,19,23)

InChI Key

NAPVXDUIFCPFRI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27249595

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.4

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.638

Distribution Coefficient, logD

1.638

Water Solubility, LogSw

-2.60

Polar Surface Area

81.116

Acid Dissociation Constant (pKa)

12.03

Base Dissociation Constant (pKb)

2.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

L386-0035 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L386-0035 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L386-0035?
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What is the minimum amount of L386-0035 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L386-0035
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L386-0035
  • 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 L386-0035 available by request