Carbendazim/triadimefon
TL;DR: Carbendazim/triadimefon (CAS 75448-56-5) is a chemical compound with molecular formula C23H25ClN6O4 and molecular weight 484.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one;methyl N-(1H-benzimidazol-2-yl)carbamate
Also Known As: Carbendazim/triadimefon, Carbendazim / triadimefon, Carbendazim mixture with triadimefon, Carbamic acid, 1H-benzimidazol-2-yl-, methyl ester, mixt. with 1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)-2-butanone, 1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one,methyl N-(1H-benzimidazol-2-yl)carbamate
| Molecular Formula | C23H25ClN6O4 |
|---|---|
| Molecular Weight | 484.16 g/mol |
| LogP | 4.8655 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 484.16257 |
| Heavy Atoms | 34 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 75448-56-5 |
|---|---|
| SMILES | CC(C)(C)C(=O)C(N1C=NC=N1)OC2=CC=C(C=C2)Cl.COC(=O)NC1=NC2=CC=CC=C2N1 |
| InChIKey | HEEWWSIOXSCLFS-UHFFFAOYSA-N |
Product Overview
Carbendazim/triadimefon (CAS 75448-56-5), with molecular formula C23H25ClN6O4 and molecular weight 484.16 g/mol. IUPAC: 1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one;methyl N-(1H-benzimidazol-2-yl)carbamate.
Chemical Property Profile of Carbendazim/triadimefon
Property Insights of Carbendazim/triadimefon
The XLogP value of 4.8655 indicates that Carbendazim/triadimefon is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbendazim/triadimefon. Following Lipinski's Rule of Five, Carbendazim/triadimefon has 2 hydrogen bond donor(s) and 7 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 Carbendazim/triadimefon?
The CAS number of Carbendazim/triadimefon is 75448-56-5.
What is the molecular formula of Carbendazim/triadimefon?
The molecular formula of Carbendazim/triadimefon is C23H25ClN6O4.
What is the molecular weight of Carbendazim/triadimefon?
The molecular weight of Carbendazim/triadimefon is 484.16 g/mol.
Where can I buy Carbendazim/triadimefon?
You can request a quote for Carbendazim/triadimefon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbendazim/triadimefon?
Yes, KEHONG BIO provides custom synthesis services for Carbendazim/triadimefon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.