Y050-3313 Screening compound: 3-[4-(morpholine-4-sulfonyl)phenyl]-N-[(oxolan-2-yl)methyl]propanamide

Y050-3313 Screening compound: 3-[4-(morpholine-4-sulfonyl)phenyl]-N-[(oxolan-2-yl)methyl]propanamide
Y050-3313 Screening compound: 3-[4-(morpholine-4-sulfonyl)phenyl]-N-[(oxolan-2-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y050-3313
3-[4-(morpholine-4-sulfonyl)phenyl]-N-[(oxolan-2-yl)methyl]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

Y050-3313

Molecular Formula

C18H26N2O5S (C18 H26 N2 O5 S)

Compound Name

3-[4-(morpholine-4-sulfonyl)phenyl]-N-[(oxolan-2-yl)methyl]propanamide

IUPAC name

3-[4-(morpholine-4-sulfonyl)phenyl]-N-[(oxolan-2-yl)methyl]propanamide

SMILES

O=C(CCc(cc1)ccc1S(N1CCOCC1)(=O)=O)NCC1OCCC1

InChI

InChI=1S/C18H26N2O5S/c21-18(19-14-16-2-1-11-25-16)8-5-15-3-6-17(7-4-15)26(22,23)20-9-12-24-13-10-20/h3-4,6-7,16H,1-2,5,8-14H2,(H,19,21)/t16-/m1/s1

InChI Key

XPVQRAQPQMCLAK-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD09877056

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.660

Distribution Coefficient, logD

0.660

Water Solubility, LogSw

-2.42

Polar Surface Area

72.712

Acid Dissociation Constant (pKa)

13.79

Base Dissociation Constant (pKb)

-0.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.10

Y050-3313 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y050-3313 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y050-3313?
Check Price and Availability of Y050-3313, 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 Y050-3313 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y050-3313
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y050-3313
  • 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 Y050-3313 available by request