D107-1025 Screening compound: 3,4,5-trimethoxy-N-(5-methyl-4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)benzamide
Chemical Structure Depiction of ChemDiv screening compound D107-1025
3,4,5-trimethoxy-N-(5-methyl-4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)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
D107-1025
Molecular Formula
C18H22N2O5 (C18 H22 N2 O5)
Compound Name
3,4,5-trimethoxy-N-(5-methyl-4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)benzamide
IUPAC name
345-trimethoxy-N-(5-methyl-4567-tetrahydro-21-benzoxazol-3-yl)benzamide
SMILES
CC1Cc2c(NC(c(cc3OC)cc(OC)c3OC)=O)onc2CC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
346.38
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.869
Distribution Coefficient, logD
2.856
Water Solubility, LogSw
-3.41
Polar Surface Area
69.817
Acid Dissociation Constant (pKa)
8.91
Base Dissociation Constant (pKb)
-4.77
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
44.40
D107-1025 in Drug Discovery
Included in Screening Libraries
CNS MPO Library (28609 compounds)
Included in 1.7M Stock Database
- Nervous system
References: we are preparing a list of scientific research reports with D107-1025 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of D107-1025, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
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)