Heptylurea
TL;DR: Heptylurea (CAS 42955-46-4) is a chemical compound with molecular formula C8H18N2O and molecular weight 158.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptylurea
Also Known As: Heptylurea, N-Heptylurea, UREA, n-HEPTYL-, 1-heptylurea, Heptylharnstoff
| Molecular Formula | C8H18N2O |
|---|---|
| Molecular Weight | 158.14 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 158.1419 |
| Heavy Atoms | 11 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 42955-46-4 |
|---|---|
| SMILES | CCCCCCCNC(=O)N |
| InChIKey | LDNJCDRFTFLQLF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Heptylurea (CAS 42955-46-4), with molecular formula C8H18N2O and molecular weight 158.14 g/mol. IUPAC: heptylurea.
Chemical Property Profile of Heptylurea
Property Insights of Heptylurea
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Heptylurea. With a topological polar surface area (TPSA) of 55.1 Ų, Heptylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptylurea has 2 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 Heptylurea?
The CAS number of Heptylurea is 42955-46-4.
What is the molecular formula of Heptylurea?
The molecular formula of Heptylurea is C8H18N2O.
What is the molecular weight of Heptylurea?
The molecular weight of Heptylurea is 158.14 g/mol.
Where can I buy Heptylurea?
You can request a quote for Heptylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptylurea?
Yes, KEHONG BIO provides custom synthesis services for Heptylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.