Y300-3788 Screening compound: 4-[(morpholin-4-yl)methyl]-N-[5-(propan-2-ylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

Y300-3788 Screening compound: 4-[(morpholin-4-yl)methyl]-N-[5-(propan-2-ylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide
Y300-3788 Screening compound: 4-[(morpholin-4-yl)methyl]-N-[5-(propan-2-ylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y300-3788
4-[(morpholin-4-yl)methyl]-N-[5-(propan-2-ylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

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

Y300-3788

Molecular Formula

C17H22N4O2S2 (C17 H22 N4 O2 S2)

Compound Name

4-[(morpholin-4-yl)methyl]-N-[5-(propan-2-ylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

IUPAC name

4-[(morpholin-4-yl)methyl]-N-[5-(propan-2-ylsulfanyl)-134-thiadiazol-2-yl]benzamide

SMILES

CC(C)Sc1nnc(NC(c2ccc(CN3CCOCC3)cc2)=O)s1

InChI

InChI=1S/C17H22N4O2S2/c1-12(2)24-17-20-19-16(25-17)18-15(22)14-5-3-13(4-6-14)11-21-7-9-23-10-8-21/h3-6,12H,7-11H2,1-2H3,(H,18,19,22)

InChI Key

HEWJIOFGAXWWRF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD22439713

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.259

Distribution Coefficient, logD

3.121

Water Solubility, LogSw

-3.37

Polar Surface Area

57.877

Acid Dissociation Constant (pKa)

8.00

Base Dissociation Constant (pKb)

6.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.10

References: we are preparing a list of scientific research reports with Y300-3788 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y300-3788?
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What is the minimum amount of Y300-3788 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y300-3788
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y300-3788
  • 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 Y300-3788 available by request