V011-6720 Screening compound: ethyl 2-[1-ethyl-3-(3-methylphenyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]propanoate

V011-6720 Screening compound: ethyl 2-[1-ethyl-3-(3-methylphenyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]propanoate
V011-6720 Screening compound: ethyl 2-[1-ethyl-3-(3-methylphenyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-6720
ethyl 2-[1-ethyl-3-(3-methylphenyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]propanoate

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

V011-6720

Molecular Formula

C19H22N4O4 (C19 H22 N4 O4)

Compound Name

ethyl 2-[1-ethyl-3-(3-methylphenyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]propanoate

IUPAC name

ethyl 2-[1-ethyl-3-(3-methylphenyl)-26-dioxo-2367-tetrahydro-1H-purin-7-yl]propanoate

SMILES

CCN(C(c1c(N2c3cc(C)ccc3)ncn1C(C)C(OCC)=O)=O)C2=O

InChI

InChI=1S/C19H22N4O4/c1-5-21-17(24)15-16(20-11-22(15)13(4)18(25)27-6-2)23(19(21)26)14-9-7-8-12(3)10-14/h7-11,13H,5-6H2,1-4H3/t13-/m0/s1

InChI Key

DBZPUMCSEQIJNP-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD19904859

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

370.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.497

Distribution Coefficient, logD

2.497

Water Solubility, LogSw

-2.48

Polar Surface Area

63.707

Acid Dissociation Constant (pKa)

15.22

Base Dissociation Constant (pKb)

2.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.80

References: we are preparing a list of scientific research reports with V011-6720 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-6720?
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What is the minimum amount of V011-6720 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-6720
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-6720
  • 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 V011-6720 available by request