环六亚甲基脲
TL;DR: 环六亚甲基脲 (CAS 25991-86-0) is a chemical compound with molecular formula C13H24N2O and molecular weight 224.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
环六亚甲基脲
bis(azepan-1-yl)methanone
Also Known As: Carboxide, Karboxid, Karboxide, Dichexamethylenecarbamide, Dihexamethylenecarbamide
| Molecular Formula | C13H24N2O |
|---|---|
| Molecular Weight | 224.19 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 224.18886 |
| Heavy Atoms | 16 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 25991-86-0 |
|---|---|
| SMILES | C1CCCN(CC1)C(=O)N2CCCCCC2 |
| InChIKey | BZDSNHCMPJUKOY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
环六亚甲基脲 (CAS 25991-86-0), with molecular formula C13H24N2O and molecular weight 224.19 g/mol. IUPAC: bis(azepan-1-yl)methanone.
Chemical Property Profile of 环六亚甲基脲
Property Insights of 环六亚甲基脲
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 环六亚甲基脲. With a topological polar surface area (TPSA) of 23.6 Ų, 环六亚甲基脲 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 环六亚甲基脲 has 0 hydrogen bond donor(s) and 1 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 环六亚甲基脲?
The CAS number of 环六亚甲基脲 is 25991-86-0.
What is the molecular formula of 环六亚甲基脲?
The molecular formula of 环六亚甲基脲 is C13H24N2O.
What is the molecular weight of 环六亚甲基脲?
The molecular weight of 环六亚甲基脲 is 224.19 g/mol.
Where can I buy 环六亚甲基脲?
You can request a quote for 环六亚甲基脲 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 环六亚甲基脲?
Yes, KEHONG BIO provides custom synthesis services for 环六亚甲基脲 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.