1503-1321 Screening compound: N-{4-[(CARBAMOYLAMINO)SULFONYL]PHENYL}-3-[(5Z)-4-OXO-5-(PHENYLMETHYLIDENE)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]PROPANAMIDE

1503-1321 Screening compound: N-{4-[(CARBAMOYLAMINO)SULFONYL]PHENYL}-3-[(5Z)-4-OXO-5-(PHENYLMETHYLIDENE)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]PROPANAMIDE
1503-1321 Screening compound: N-{4-[(CARBAMOYLAMINO)SULFONYL]PHENYL}-3-[(5Z)-4-OXO-5-(PHENYLMETHYLIDENE)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]PROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound 1503-1321
N-{4-[(CARBAMOYLAMINO)SULFONYL]PHENYL}-3-[(5Z)-4-OXO-5-(PHENYLMETHYLIDENE)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]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

1503-1321

Molecular Formula

C20H18N4O5S3 (C20 H18 N4 O5 S3)

Compound Name

N-{4-[(CARBAMOYLAMINO)SULFONYL]PHENYL}-3-[(5Z)-4-OXO-5-(PHENYLMETHYLIDENE)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]PROPANAMIDE

IUPAC name

n/a

SMILES

NC(NS(c(cc1)ccc1NC(CCN(C(/C(/S1)=C/c2ccccc2)=O)C1=S)=O)(=O)=O)=O

InChI

InChI=1S/C20H18N4O5S3/c21-19(27)23-32(28,29)15-8-6-14(7-9-15)22-17(25)10-11-24-18(26)16(31-20(24)30)12-13-4-2-1-3-5-13/h1-9,12H,10-11H2,(H,22,25)(H3,21,23,27)

InChI Key

LBJMKDCOEDDRPG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00858894

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.58

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.037

Distribution Coefficient, logD

0.388

Water Solubility, LogSw

-2.87

Polar Surface Area

115.368

Acid Dissociation Constant (pKa)

5.76

Base Dissociation Constant (pKb)

-1.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

1503-1321 in Drug Discovery

Included in Screening Libraries

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 1503-1321 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1503-1321?
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What is the minimum amount of 1503-1321 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1503-1321
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1503-1321
  • 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 1503-1321 available by request