C301-5140 Screening compound: 1,3-dimethyl 5-{3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamido}benzene-1,3-dicarboxylate

C301-5140 Screening compound: 1,3-dimethyl 5-{3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamido}benzene-1,3-dicarboxylate
C301-5140 Screening compound: 1,3-dimethyl 5-{3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamido}benzene-1,3-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-5140
1,3-dimethyl 5-{3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamido}benzene-1,3-dicarboxylate

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

C301-5140

Molecular Formula

C18H17N3O7S2 (C18 H17 N3 O7 S2)

Compound Name

1,3-dimethyl 5-{3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamido}benzene-1,3-dicarboxylate

IUPAC name

13-dimethyl 5-{37-dimethyl-5-oxo-5H-[13]thiazolo[32-a]pyrimidine-6-sulfonamido}benzene-13-dicarboxylate

SMILES

CC(N1C2=O)=CSC1=NC(C)=C2S(Nc1cc(C(OC)=O)cc(C(OC)=O)c1)(=O)=O

InChI

InChI=1S/C18H17N3O7S2/c1-9-8-29-18-19-10(2)14(15(22)21(9)18)30(25,26)20-13-6-11(16(23)27-3)5-12(7-13)17(24)28-4/h5-8,20H,1-4H3

InChI Key

UVVVLGPDKKXOGX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14743868

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.48

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.085

Distribution Coefficient, logD

0.535

Water Solubility, LogSw

-2.58

Polar Surface Area

107.767

Acid Dissociation Constant (pKa)

5.86

Base Dissociation Constant (pKb)

-5.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with C301-5140 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-5140?
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What is the minimum amount of C301-5140 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-5140
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-5140
  • 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 C301-5140 available by request