G706-1696 Screening compound: N-(butan-2-yl)-2-(propan-2-yl)-1,3-benzoxazole-6-carboxamide
Chemical Structure Depiction of ChemDiv screening compound G706-1696
N-(butan-2-yl)-2-(propan-2-yl)-1,3-benzoxazole-6-carboxamide
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
G706-1696
Molecular Formula
C15H20N2O2 (C15 H20 N2 O2)
Compound Name
N-(butan-2-yl)-2-(propan-2-yl)-1,3-benzoxazole-6-carboxamide
IUPAC name
N-(butan-2-yl)-2-(propan-2-yl)-13-benzoxazole-6-carboxamide
SMILES
CCC(C)NC(c(cc1)cc2c1nc(C(C)C)o2)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
260.34
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
3.187
Distribution Coefficient, logD
3.187
Water Solubility, LogSw
-3.38
Polar Surface Area
41.447
Acid Dissociation Constant (pKa)
14.72
Base Dissociation Constant (pKb)
-0.19
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
46.70
G706-1696 in Drug Discovery
Included in Screening Libraries
Fragments Library (11262 compounds)
Included in 1.7M Stock Database
- Fragments
References: we are preparing a list of scientific research reports with G706-1696 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)