Y502-7217 Screening compound: 2-{4-[(4-chloro-3,5-dimethylphenoxy)methyl]benzoyl}-N~1~-(3-morpholinopropyl)-1-hydrazinecarbothioamide

Y502-7217 Screening compound: 2-{4-[(4-chloro-3,5-dimethylphenoxy)methyl]benzoyl}-N~1~-(3-morpholinopropyl)-1-hydrazinecarbothioamide
Y502-7217 Screening compound: 2-{4-[(4-chloro-3,5-dimethylphenoxy)methyl]benzoyl}-N~1~-(3-morpholinopropyl)-1-hydrazinecarbothioamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y502-7217
2-{4-[(4-chloro-3,5-dimethylphenoxy)methyl]benzoyl}-N~1~-(3-morpholinopropyl)-1-hydrazinecarbothioamide

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

Y502-7217

Molecular Formula

C24H31ClN4O3S (C24 H31 ClN4 O3 S)

Compound Name

2-{4-[(4-chloro-3,5-dimethylphenoxy)methyl]benzoyl}-N~1~-(3-morpholinopropyl)-1-hydrazinecarbothioamide

IUPAC name

4-[(4-chloro-35-dimethylphenoxy)methyl]-N-({[3-(morpholin-4-yl)propyl]carbamothioyl}amino)benzamide

SMILES

Cc1cc(OCc(cc2)ccc2C(NNC(NCCCN2CCOCC2)=S)=O)cc(C)c1Cl

InChI

InChI=1S/C24H31ClN4O3S/c1-17-14-21(15-18(2)22(17)25)32-16-19-4-6-20(7-5-19)23(30)27-28-24(33)26-8-3-9-29-10-12-31-13-11-29/h4-7,14-15H,3,8-13,16H2,1-2H3,(H,27,30)(H2,26,28,33)

InChI Key

FNMFIOHUVPLWPB-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.05

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.693

Distribution Coefficient, logD

3.693

Water Solubility, LogSw

-4.43

Polar Surface Area

67.448

Acid Dissociation Constant (pKa)

6.27

Base Dissociation Constant (pKb)

7.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.67

Y502-7217 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with Y502-7217 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y502-7217?
Check Price and Availability of Y502-7217, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of Y502-7217 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y502-7217
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y502-7217
  • 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 Y502-7217 available by request