1493-0393 Screening compound: 3-{[(adamantan-1-yl)formohydrazido]carbonyl}-1-methylpyridin-1-ium
Chemical Structure Depiction of ChemDiv screening compound 1493-0393
3-{[(adamantan-1-yl)formohydrazido]carbonyl}-1-methylpyridin-1-ium
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
1493-0393
Molecular Formula
C18H24N3O2 (C18 H24 N3 O2)
Compound Name
3-{[(adamantan-1-yl)formohydrazido]carbonyl}-1-methylpyridin-1-ium
IUPAC name
3-{[(adamantan-1-yl)formohydrazido]carbonyl}-1-methylpyridin-1-ium
SMILES
C[n+]1cccc(C(NNC(C2(CC(C3)C4)CC4CC3C2)=O)=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
I-
Molecular Weight
314.41
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
2.725
Distribution Coefficient, logD
2.724
Water Solubility, LogSw
-2.82
Polar Surface Area
54.727
Acid Dissociation Constant (pKa)
10.38
Base Dissociation Constant (pKb)
-1.37
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
61.10
1493-0393 in Drug Discovery
Included in Screening Libraries
Frequent Hitters Library (7624 compounds)
Regenerative Medicine Focused Library (23016 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- Pool
- Musculoskeletal
- Digestive system
- Hemic and lymphatic
- Cardiovascular
- Skin
- wounds
References: we are preparing a list of scientific research reports with 1493-0393 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)