F207-0483 Screening compound: methyl 3-({4-[(butan-2-yl)carbamoyl]phenyl}methyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate

F207-0483 Screening compound: methyl 3-({4-[(butan-2-yl)carbamoyl]phenyl}methyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
F207-0483 Screening compound: methyl 3-({4-[(butan-2-yl)carbamoyl]phenyl}methyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F207-0483
methyl 3-({4-[(butan-2-yl)carbamoyl]phenyl}methyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate

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

F207-0483

Molecular Formula

C22H23N3O4S (C22 H23 N3 O4 S)

Compound Name

methyl 3-({4-[(butan-2-yl)carbamoyl]phenyl}methyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate

IUPAC name

methyl 3-({4-[(butan-2-yl)carbamoyl]phenyl}methyl)-4-oxo-2-sulfanylidene-1234-tetrahydroquinazoline-7-carboxylate

SMILES

CCC(C)NC(c1ccc(CN(C(c(ccc(C(OC)=O)c2)c2N2)=O)C2=S)cc1)=O

InChI

InChI=1S/C22H23N3O4S/c1-4-13(2)23-19(26)15-7-5-14(6-8-15)12-25-20(27)17-10-9-16(21(28)29-3)11-18(17)24-22(25)30/h5-11,13H,4,12H2,1-3H3,(H,23,26)(H,24,30)/t13-/m0/s1

InChI Key

JGWFVHOUTSAQPO-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD14944681

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.326

Distribution Coefficient, logD

3.325

Water Solubility, LogSw

-3.59

Polar Surface Area

72.618

Acid Dissociation Constant (pKa)

9.91

Base Dissociation Constant (pKb)

-1.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with F207-0483 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F207-0483?
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What is the minimum amount of F207-0483 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F207-0483
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F207-0483
  • 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 F207-0483 available by request