Y021-1973 Screening compound: N-(2-methoxyphenyl)-N'-[4-(4-methoxyphenyl)-6-oxo-1,6-dihydro-2-pyrimidinyl]guanidine

Y021-1973 Screening compound: N-(2-methoxyphenyl)-N'-[4-(4-methoxyphenyl)-6-oxo-1,6-dihydro-2-pyrimidinyl]guanidine
Y021-1973 Screening compound: N-(2-methoxyphenyl)-N'-[4-(4-methoxyphenyl)-6-oxo-1,6-dihydro-2-pyrimidinyl]guanidine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-1973
N-(2-methoxyphenyl)-N'-[4-(4-methoxyphenyl)-6-oxo-1,6-dihydro-2-pyrimidinyl]guanidine

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

Y021-1973

Molecular Formula

C19H19N5O3 (C19 H19 N5 O3)

Compound Name

N-(2-methoxyphenyl)-N'-[4-(4-methoxyphenyl)-6-oxo-1,6-dihydro-2-pyrimidinyl]guanidine

IUPAC name

N-(2-methoxyphenyl)-N'-[4-(4-methoxyphenyl)-6-oxo-16-dihydropyrimidin-2-yl]guanidine

SMILES

COc(cc1)ccc1C(N=C(NC(Nc(cccc1)c1OC)=N)N1)=CC1=O

InChI

InChI=1S/C19H19N5O3/c1-26-13-9-7-12(8-10-13)15-11-17(25)23-19(22-15)24-18(20)21-14-5-3-4-6-16(14)27-2/h3-11H,1-2H3,(H4,20,21,22,23,24,25)

InChI Key

NEBSKRHFENEKGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07157648

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.742

Distribution Coefficient, logD

2.652

Water Solubility, LogSw

-3.49

Polar Surface Area

86.757

Acid Dissociation Constant (pKa)

9.42

Base Dissociation Constant (pKb)

6.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.53

Y021-1973 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y021-1973 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-1973?
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What is the minimum amount of Y021-1973 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-1973
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-1973
  • 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 Y021-1973 available by request