G345-0128 Screening compound: 4-({1-[(3-fluorophenyl)methyl]-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-(3-methylbutyl)benzamide

G345-0128 Screening compound: 4-({1-[(3-fluorophenyl)methyl]-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-(3-methylbutyl)benzamide
G345-0128 Screening compound: 4-({1-[(3-fluorophenyl)methyl]-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-(3-methylbutyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G345-0128
4-({1-[(3-fluorophenyl)methyl]-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-(3-methylbutyl)benzamide

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

G345-0128

Molecular Formula

C30H32FN3O5 (C30 H32 FN3 O5)

Compound Name

4-({1-[(3-fluorophenyl)methyl]-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-(3-methylbutyl)benzamide

IUPAC name

4-({1-[(3-fluorophenyl)methyl]-67-dimethoxy-24-dioxo-1234-tetrahydroquinazolin-3-yl}methyl)-N-(3-methylbutyl)benzamide

SMILES

CC(C)CCNC(c1ccc(CN(C(c(cc(c(OC)c2)OC)c2N2Cc3cccc(F)c3)=O)C2=O)cc1)=O

InChI

InChI=1S/C30H32FN3O5/c1-19(2)12-13-32-28(35)22-10-8-20(9-11-22)17-34-29(36)24-15-26(38-3)27(39-4)16-25(24)33(30(34)37)18-21-6-5-7-23(31)14-21/h5-11,14-16,19H,12-13,17-18H2,1-4H3,(H,32,35)

InChI Key

ORGLCDRYVFLNPZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27136403

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

533.6

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.338

Distribution Coefficient, logD

5.338

Water Solubility, LogSw

-5.33

Polar Surface Area

71.054

Acid Dissociation Constant (pKa)

12.79

Base Dissociation Constant (pKb)

-2.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with G345-0128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G345-0128?
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What is the minimum amount of G345-0128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G345-0128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G345-0128
  • 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 G345-0128 available by request