3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide
TL;DR: 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide (CAS 438220-66-7) is a chemical compound with molecular formula C13H18ClN5O and molecular weight 295.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chloro-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide
Also Known As: 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide, 3-(3-chloro-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide, 1-(3-chloro-1,2,4-triazolyl)adamantane-3-carbohydrazide, 3-(3-chloro-1H-1,2,4-triazol-1-yl)-1-adamantanecarbohydrazide, 3-(3-CHLORO-[1,2,4]TRIAZOL-1-YL)-ADAMANTANE-1-CARBOXYLIC ACID HYDRAZIDE
| Molecular Formula | C13H18ClN5O |
|---|---|
| Molecular Weight | 295.12 g/mol |
| LogP | 1.2169 |
| Topological Polar Surface Area | 85.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 295.12 |
| Heavy Atoms | 20 |
| Complexity | 556.8627 |
Chemical Identifiers
| CAS Number | 438220-66-7 |
|---|---|
| SMILES | C1C2CC3(CC1CC(C2)(C3)N4C=NC(=N4)Cl)C(=O)NN |
Product Overview
3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide (CAS 438220-66-7), with molecular formula C13H18ClN5O and molecular weight 295.12 g/mol. IUPAC: 3-(3-chloro-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide.
Chemical Property Profile of 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide
Property Insights of 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide
The XLogP value of 1.2169 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide. The TPSA of 85.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide. Following Lipinski's Rule of Five, 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide?
The CAS number of 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide is 438220-66-7.
What is the molecular formula of 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide?
The molecular formula of 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide is C13H18ClN5O.
What is the molecular weight of 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide?
The molecular weight of 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide is 295.12 g/mol.
Where can I buy 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide?
You can request a quote for 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-chloro-1H-1,2,4-triazol-1-yl)adamantane-1-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.