5594-1159 Screening compound: 2-(benzylsulfanyl)-4,6,7-trimethylquinazoline
Chemical Structure Depiction of ChemDiv screening compound 5594-1159
2-(benzylsulfanyl)-4,6,7-trimethylquinazoline
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
5594-1159
Molecular Formula
C18H18N2S (C18 H18 N2 S)
Compound Name
2-(benzylsulfanyl)-4,6,7-trimethylquinazoline
IUPAC name
2-(benzylsulfanyl)-467-trimethylquinazoline
SMILES
Cc(cc1c(C)n2)c(C)cc1nc2SCc1ccccc1
InChI
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
294.42
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
2
Partition Coefficient, logP
5.214
Distribution Coefficient, logD
5.214
Water Solubility, LogSw
-5.31
Polar Surface Area
17.552
Acid Dissociation Constant (pKa)
22.07
Base Dissociation Constant (pKb)
1.65
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
22.20
References: we are preparing a list of scientific research reports with 5594-1159 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)