3341-1504 Screening compound: 1-[4-(dimethylsulfamoyl)benzoyl]-3-[5-(4-nitrobenzenesulfonyl)-1,3-thiazol-2-yl]thiourea

3341-1504 Screening compound: 1-[4-(dimethylsulfamoyl)benzoyl]-3-[5-(4-nitrobenzenesulfonyl)-1,3-thiazol-2-yl]thiourea
3341-1504 Screening compound: 1-[4-(dimethylsulfamoyl)benzoyl]-3-[5-(4-nitrobenzenesulfonyl)-1,3-thiazol-2-yl]thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound 3341-1504
1-[4-(dimethylsulfamoyl)benzoyl]-3-[5-(4-nitrobenzenesulfonyl)-1,3-thiazol-2-yl]thiourea

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

3341-1504

Molecular Formula

C19H17N5O7S4 (C19 H17 N5 O7 S4)

Compound Name

1-[4-(dimethylsulfamoyl)benzoyl]-3-[5-(4-nitrobenzenesulfonyl)-1,3-thiazol-2-yl]thiourea

IUPAC name

1-[4-(dimethylsulfamoyl)benzoyl]-3-[5-(4-nitrobenzenesulfonyl)-13-thiazol-2-yl]thiourea

SMILES

CN(C)S(c(cc1)ccc1C(NC(Nc(s1)ncc1S(c(cc1)ccc1[N+]([O-])=O)(=O)=O)=S)=O)(=O)=O

InChI

InChI=1S/C19H17N5O7S4/c1-23(2)35(30,31)15-7-3-12(4-8-15)17(25)21-18(32)22-19-20-11-16(33-19)34(28,29)14-9-5-13(6-10-14)24(26)27/h3-11H,1-2H3,(H2,20,21,22,25,32)

InChI Key

QTRHABSRRKSZNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02927324

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

555.64

Hydrogen Bond Acceptors Count

18.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

3.263

Distribution Coefficient, logD

3.261

Water Solubility, LogSw

-3.81

Polar Surface Area

140.354

Acid Dissociation Constant (pKa)

9.73

Base Dissociation Constant (pKb)

-2.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

3341-1504 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3341-1504 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3341-1504?
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What is the minimum amount of 3341-1504 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3341-1504
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3341-1504
  • 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 3341-1504 available by request