8010-6507 Screening compound: 6,8-dibromo-4,4-dimethyl-2-(trichloromethyl)-1,4-dihydro-2H-3,1-benzoxazine
Chemical Structure Depiction of ChemDiv screening compound 8010-6507
6,8-dibromo-4,4-dimethyl-2-(trichloromethyl)-1,4-dihydro-2H-3,1-benzoxazine
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
8010-6507
Molecular Formula
C11H10Br2Cl3NO (C11 H10 Br2 Cl3 NO)
Compound Name
6,8-dibromo-4,4-dimethyl-2-(trichloromethyl)-1,4-dihydro-2H-3,1-benzoxazine
IUPAC name
68-dibromo-44-dimethyl-2-(trichloromethyl)-24-dihydro-1H-31-benzoxazine
SMILES
CC(C)(c1cc(Br)c2)OC(C(Cl)(Cl)Cl)Nc1c2Br
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
438.37
Hydrogen Bond Acceptors Count
1.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
1.00
Number of Nitrogen and Oxygen Atoms
2
Partition Coefficient, logP
5.262
Distribution Coefficient, logD
5.262
Water Solubility, LogSw
-5.77
Polar Surface Area
17.920
Acid Dissociation Constant (pKa)
12.78
Base Dissociation Constant (pKb)
-3.28
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
45.46
References: we are preparing a list of scientific research reports with 8010-6507 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)