Y030-1695 Screening compound: 5-chloro-N-[(1,4-dioxan-2-yl)methyl]-2-methoxy-N-methylbenzamide

Y030-1695 Screening compound: 5-chloro-N-[(1,4-dioxan-2-yl)methyl]-2-methoxy-N-methylbenzamide
Y030-1695 Screening compound: 5-chloro-N-[(1,4-dioxan-2-yl)methyl]-2-methoxy-N-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-1695
5-chloro-N-[(1,4-dioxan-2-yl)methyl]-2-methoxy-N-methylbenzamide

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

Y030-1695

Molecular Formula

C14H18ClNO4 (C14 H18 ClNO4)

Compound Name

5-chloro-N-[(1,4-dioxan-2-yl)methyl]-2-methoxy-N-methylbenzamide

IUPAC name

5-chloro-N-[(14-dioxan-2-yl)methyl]-2-methoxy-N-methylbenzamide

SMILES

CN(CC1OCCOC1)C(c(cc(cc1)Cl)c1OC)=O

InChI

InChI=1S/C14H18ClNO4/c1-16(8-11-9-19-5-6-20-11)14(17)12-7-10(15)3-4-13(12)18-2/h3-4,7,11H,5-6,8-9H2,1-2H3/t11-/m0/s1

InChI Key

HSIFMWQIWQRODJ-NSHDSACASA-N

MDL Number (MFCD)

MFCD09271347

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.75

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.187

Distribution Coefficient, logD

1.187

Water Solubility, LogSw

-2.59

Polar Surface Area

40.714

Acid Dissociation Constant (pKa)

26.58

Base Dissociation Constant (pKb)

-2.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

Y030-1695 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Soluble Diversity Library (15920 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with Y030-1695 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-1695?
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What is the minimum amount of Y030-1695 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-1695
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-1695
  • 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 Y030-1695 available by request