Butocarboxim sulfoxide
TL;DR: Butocarboxim sulfoxide (CAS 35817-27-7) is a chemical compound with molecular formula C7H14N2O3S and molecular weight 206.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-3-methylsulfinylbutan-2-ylideneamino] N-methylcarbamate
Also Known As: Butocarboxim sulfoxide, Butocarboximsulfoxide, butocarboxim-sulfoxide, Butocarboxim sulphoxide, Decanoic acid, octadecyl ester
| Molecular Formula | C7H14N2O3S |
|---|---|
| Molecular Weight | 206.07 g/mol |
| LogP | 0.4853 |
| Topological Polar Surface Area | 67.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.07251 |
| Heavy Atoms | 13 |
| Complexity | 239.89215 |
Chemical Identifiers
| CAS Number | 35817-27-7 |
|---|---|
| SMILES | CC(/C(=N/OC(=O)NC)/C)S(=O)C |
Product Overview
Butocarboxim sulfoxide (CAS 35817-27-7), with molecular formula C7H14N2O3S and molecular weight 206.07 g/mol. IUPAC: [(E)-3-methylsulfinylbutan-2-ylideneamino] N-methylcarbamate.
Chemical Property Profile of Butocarboxim sulfoxide
Property Insights of Butocarboxim sulfoxide
The XLogP value of 0.4853 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butocarboxim sulfoxide. The TPSA of 67.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Butocarboxim sulfoxide. Following Lipinski's Rule of Five, Butocarboxim sulfoxide has 1 hydrogen bond donor(s) and 4 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 Butocarboxim sulfoxide?
The CAS number of Butocarboxim sulfoxide is 35817-27-7.
What is the molecular formula of Butocarboxim sulfoxide?
The molecular formula of Butocarboxim sulfoxide is C7H14N2O3S.
What is the molecular weight of Butocarboxim sulfoxide?
The molecular weight of Butocarboxim sulfoxide is 206.07 g/mol.
Where can I buy Butocarboxim sulfoxide?
You can request a quote for Butocarboxim sulfoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butocarboxim sulfoxide?
Yes, KEHONG BIO provides custom synthesis services for Butocarboxim sulfoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.