M107-0364 Screening compound: N-[(2-methylphenyl)methyl]-3-[(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)sulfanyl]propanamide

M107-0364 Screening compound: N-[(2-methylphenyl)methyl]-3-[(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)sulfanyl]propanamide
M107-0364 Screening compound: N-[(2-methylphenyl)methyl]-3-[(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)sulfanyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M107-0364
N-[(2-methylphenyl)methyl]-3-[(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)sulfanyl]propanamide

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

M107-0364

Molecular Formula

C19H23N5O3S (C19 H23 N5 O3 S)

Compound Name

N-[(2-methylphenyl)methyl]-3-[(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)sulfanyl]propanamide

IUPAC name

N-[(2-methylphenyl)methyl]-3-[(139-trimethyl-26-dioxo-2369-tetrahydro-1H-purin-8-yl)sulfanyl]propanamide

SMILES

Cc1c(CNC(CCSc(n2C)nc(C(N3C)=O)c2N(C)C3=O)=O)cccc1

InChI

InChI=1S/C19H23N5O3S/c1-12-7-5-6-8-13(12)11-20-14(25)9-10-28-18-21-15-16(22(18)2)23(3)19(27)24(4)17(15)26/h5-8H,9-11H2,1-4H3,(H,20,25)

InChI Key

CGRNWGQEJLDJBC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27497076

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.770

Distribution Coefficient, logD

2.770

Water Solubility, LogSw

-3.05

Polar Surface Area

68.511

Acid Dissociation Constant (pKa)

12.24

Base Dissociation Constant (pKb)

2.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

References: we are preparing a list of scientific research reports with M107-0364 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M107-0364?
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What is the minimum amount of M107-0364 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M107-0364
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M107-0364
  • 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 M107-0364 available by request