Didesmethylisoproturon
TL;DR: Didesmethylisoproturon (CAS 6343-32-4) is a chemical compound with molecular formula C10H14N2O and molecular weight 178.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-propan-2-ylphenyl)urea
Also Known As: isoproturon-didemethyl, Didesmethylisoproturon, 1-(4-Isopropylphenyl)urea, Didemethylisoproturon, Isoproturon-desmethyl
| Molecular Formula | C10H14N2O |
|---|---|
| Molecular Weight | 178.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.11061 |
| Heavy Atoms | 13 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 6343-32-4 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)NC(=O)N |
| InChIKey | ABBKOIZWGCVCKE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Didesmethylisoproturon (CAS 6343-32-4), with molecular formula C10H14N2O and molecular weight 178.11 g/mol. IUPAC: (4-propan-2-ylphenyl)urea.
Chemical Property Profile of Didesmethylisoproturon
Property Insights of Didesmethylisoproturon
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Didesmethylisoproturon. With a topological polar surface area (TPSA) of 55.1 Ų, Didesmethylisoproturon exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Didesmethylisoproturon 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 Didesmethylisoproturon?
The CAS number of Didesmethylisoproturon is 6343-32-4.
What is the molecular formula of Didesmethylisoproturon?
The molecular formula of Didesmethylisoproturon is C10H14N2O.
What is the molecular weight of Didesmethylisoproturon?
The molecular weight of Didesmethylisoproturon is 178.11 g/mol.
Where can I buy Didesmethylisoproturon?
You can request a quote for Didesmethylisoproturon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Didesmethylisoproturon?
Yes, KEHONG BIO provides custom synthesis services for Didesmethylisoproturon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.