1-n-Butylcarbamoyl oxfendazole
TL;DR: 1-n-Butylcarbamoyl oxfendazole (CAS 6687-88-3) is a chemical compound with molecular formula C20H22N4O4S and molecular weight 414.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[5-(benzenesulfinyl)-1-(butylcarbamoyl)benzimidazol-2-yl]carbamate
Also Known As: C4-Ofz, 1-n-Butylcarbamoyl oxfendazole, Carbamic acid, (1-((butylamino)carbonyl)-5-(phenylsulfinyl)-1H-benzimidazol-2-yl)-, methyl ester, methyl N-[5-(benzenesulfinyl)-1-(butylcarbamoyl)benzimidazol-2-yl]carbamate, methyl[1-(butylcarbamoyl)-5-(phenylsulfinyl)-1h-benzimidazol-2-yl]carbamate
| Molecular Formula | C20H22N4O4S |
|---|---|
| Molecular Weight | 414.14 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 414.13617 |
| Heavy Atoms | 29 |
| Complexity | 599.0 |
Chemical Identifiers
| CAS Number | 6687-88-3 |
|---|---|
| SMILES | CCCCNC(=O)N1C2=C(C=C(C=C2)S(=O)C3=CC=CC=C3)N=C1NC(=O)OC |
| InChIKey | XAYHPUMQAHCXBN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-n-Butylcarbamoyl oxfendazole (CAS 6687-88-3), with molecular formula C20H22N4O4S and molecular weight 414.14 g/mol. IUPAC: methyl N-[5-(benzenesulfinyl)-1-(butylcarbamoyl)benzimidazol-2-yl]carbamate.
Chemical Property Profile of 1-n-Butylcarbamoyl oxfendazole
Property Insights of 1-n-Butylcarbamoyl oxfendazole
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-n-Butylcarbamoyl oxfendazole. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-n-Butylcarbamoyl oxfendazole. Following Lipinski's Rule of Five, 1-n-Butylcarbamoyl oxfendazole has 2 hydrogen bond donor(s) and 6 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 1-n-Butylcarbamoyl oxfendazole?
The CAS number of 1-n-Butylcarbamoyl oxfendazole is 6687-88-3.
What is the molecular formula of 1-n-Butylcarbamoyl oxfendazole?
The molecular formula of 1-n-Butylcarbamoyl oxfendazole is C20H22N4O4S.
What is the molecular weight of 1-n-Butylcarbamoyl oxfendazole?
The molecular weight of 1-n-Butylcarbamoyl oxfendazole is 414.14 g/mol.
Where can I buy 1-n-Butylcarbamoyl oxfendazole?
You can request a quote for 1-n-Butylcarbamoyl oxfendazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-n-Butylcarbamoyl oxfendazole?
Yes, KEHONG BIO provides custom synthesis services for 1-n-Butylcarbamoyl oxfendazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.