0111-0165 Screening compound: 1,3-bis(adamantan-1-yl)urea
Chemical Structure Depiction of ChemDiv screening compound 0111-0165
1,3-bis(adamantan-1-yl)urea
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
0111-0165
Molecular Formula
C21H32N2O (C21 H32 N2 O)
Compound Name
1,3-bis(adamantan-1-yl)urea
IUPAC name
13-bis(adamantan-1-yl)urea
SMILES
O=C(NC1(CC(C2)C3)CC3CC2C1)NC1(CC(C2)C3)CC3CC2C1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
328.5
Hydrogen Bond Acceptors Count
2.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
5.151
Distribution Coefficient, logD
5.148
Water Solubility, LogSw
-5.26
Polar Surface Area
34.577
Acid Dissociation Constant (pKa)
16.48
Base Dissociation Constant (pKb)
2.83
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
95.20
0111-0165 in Drug Discovery
Included in Screening Libraries
Human Phosphatases Annotated Library (206 compounds)
Regenerative Medicine Focused Library (23016 compounds)
Therapeutical Diversity Annotated Library (7563 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Ion Channels Focused Library (26372 compounds)
Included in 1.7M Stock Database
- Eye
- Musculoskeletal
- Digestive system
- Hemic and lymphatic
- Cardiovascular
- Skin
- wounds
- Nervous system
- Cardiovascular
- GPCR
- Ion Channels
- Ion Channels
- Receptor's ligands
References: we are preparing a list of scientific research reports with 0111-0165 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of 0111-0165, 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)