C200-3038 Screening compound: 2-[3-isopropyl-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl]-N~1~-(4-methylbenzyl)acetamide

C200-3038 Screening compound: 2-[3-isopropyl-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl]-N~1~-(4-methylbenzyl)acetamide
C200-3038 Screening compound: 2-[3-isopropyl-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl]-N~1~-(4-methylbenzyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-3038
2-[3-isopropyl-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl]-N~1~-(4-methylbenzyl)acetamide

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

C200-3038

Molecular Formula

C23H23N3O4 (C23 H23 N3 O4)

Compound Name

2-[3-isopropyl-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl]-N~1~-(4-methylbenzyl)acetamide

IUPAC name

2-[46-dioxo-5-(propan-2-yl)-8-oxa-35-diazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)911-tetraen-3-yl]-N-[(4-methylphenyl)methyl]acetamide

SMILES

CC(C)N(C(c(oc1c2cccc1)c2N1CC(NCc2ccc(C)cc2)=O)=O)C1=O

InChI

InChI=1S/C23H23N3O4/c1-14(2)26-22(28)21-20(17-6-4-5-7-18(17)30-21)25(23(26)29)13-19(27)24-12-16-10-8-15(3)9-11-16/h4-11,14H,12-13H2,1-3H3,(H,24,27)

InChI Key

NTXXGJSBJSHNRF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14726692

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.929

Distribution Coefficient, logD

3.929

Water Solubility, LogSw

-3.93

Polar Surface Area

65.035

Acid Dissociation Constant (pKa)

13.33

Base Dissociation Constant (pKb)

-1.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with C200-3038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-3038?
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What is the minimum amount of C200-3038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-3038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-3038
  • 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 C200-3038 available by request