C597-0718 Screening compound: methyl 2-[2-(N-methyl1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamido)acetamido]acetate

C597-0718 Screening compound: methyl 2-[2-(N-methyl1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamido)acetamido]acetate
C597-0718 Screening compound: methyl 2-[2-(N-methyl1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamido)acetamido]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound C597-0718
methyl 2-[2-(N-methyl1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamido)acetamido]acetate

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

C597-0718

Molecular Formula

C16H20N4O7S (C16 H20 N4 O7 S)

Compound Name

methyl 2-[2-(N-methyl1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamido)acetamido]acetate

IUPAC name

methyl 2-[2-(N-methyl13-dimethyl-24-dioxo-1234-tetrahydroquinazoline-6-sulfonamido)acetamido]acetate

SMILES

CN(CC(NCC(OC)=O)=O)S(c(cc1)cc(C(N2C)=O)c1N(C)C2=O)(=O)=O

InChI

InChI=1S/C16H20N4O7S/c1-18(9-13(21)17-8-14(22)27-4)28(25,26)10-5-6-12-11(7-10)15(23)20(3)16(24)19(12)2/h5-7H,8-9H2,1-4H3,(H,17,21)

InChI Key

UATFRIIVNVJPHB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14774636

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.42

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

-0.166

Distribution Coefficient, logD

-0.166

Water Solubility, LogSw

-2.57

Polar Surface Area

109.228

Acid Dissociation Constant (pKa)

13.10

Base Dissociation Constant (pKb)

-2.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with C597-0718 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C597-0718?
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What is the minimum amount of C597-0718 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C597-0718
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C597-0718
  • 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 C597-0718 available by request