SA59-0571 Screening compound: 3-(3,4-dimethylphenyl)-1-{2-[N-(oxan-4-yl)methanesulfonamido]ethyl}urea

SA59-0571 Screening compound: 3-(3,4-dimethylphenyl)-1-{2-[N-(oxan-4-yl)methanesulfonamido]ethyl}urea
SA59-0571 Screening compound: 3-(3,4-dimethylphenyl)-1-{2-[N-(oxan-4-yl)methanesulfonamido]ethyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound SA59-0571
3-(3,4-dimethylphenyl)-1-{2-[N-(oxan-4-yl)methanesulfonamido]ethyl}urea

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

SA59-0571

Molecular Formula

C17H27N3O4S (C17 H27 N3 O4 S)

Compound Name

3-(3,4-dimethylphenyl)-1-{2-[N-(oxan-4-yl)methanesulfonamido]ethyl}urea

IUPAC name

3-(34-dimethylphenyl)-1-{2-[N-(oxan-4-yl)methanesulfonamido]ethyl}urea

SMILES

Cc(cc1)c(C)cc1NC(NCCN(C1CCOCC1)S(C)(=O)=O)=O

InChI

InChI=1S/C17H27N3O4S/c1-13-4-5-15(12-14(13)2)19-17(21)18-8-9-20(25(3,22)23)16-6-10-24-11-7-16/h4-5,12,16H,6-11H2,1-3H3,(H2,18,19,21)

InChI Key

HOZBJOFBNGXQMH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32000663

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.271

Distribution Coefficient, logD

2.271

Water Solubility, LogSw

-2.92

Polar Surface Area

73.014

Acid Dissociation Constant (pKa)

13.88

Base Dissociation Constant (pKb)

2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.82

References: we are preparing a list of scientific research reports with SA59-0571 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA59-0571?
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What is the minimum amount of SA59-0571 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA59-0571
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA59-0571
  • 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 SA59-0571 available by request