N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide
TL;DR: N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide (CAS 27182-40-7) is a chemical compound with molecular formula C13H17N3O and molecular weight 231.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide
Also Known As: N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide, N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzenecarbohydrazide
| Molecular Formula | C13H17N3O |
|---|---|
| Molecular Weight | 231.14 g/mol |
| LogP | 1.8935 |
| Topological Polar Surface Area | 53.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.13716 |
| Heavy Atoms | 17 |
| Complexity | 400.3854 |
Chemical Identifiers
| CAS Number | 27182-40-7 |
|---|---|
| SMILES | C1CCC(=NCC1)NNC(=O)C2=CC=CC=C2 |
Product Overview
N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide (CAS 27182-40-7), with molecular formula C13H17N3O and molecular weight 231.14 g/mol. IUPAC: N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide.
Chemical Property Profile of N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide
Property Insights of N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide
The XLogP value of 1.8935 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide. With a topological polar surface area (TPSA) of 53.49 Ų, N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide has 2 hydrogen bond donor(s) and 3 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 N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide?
The CAS number of N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide is 27182-40-7.
What is the molecular formula of N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide?
The molecular formula of N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide is C13H17N3O.
What is the molecular weight of N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide?
The molecular weight of N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide is 231.14 g/mol.
Where can I buy N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide?
You can request a quote for N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.