CAS 66637-35-2 - C9H12Cl3N3O3S2
TL;DR: CAS 66637-35-2 - C9H12Cl3N3O3S2 (CAS 66637-35-2) is a chemical compound with molecular formula C9H12Cl3N3O3S2 and molecular weight 378.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3,4-dimethyl-5-oxothiomorpholin-2-ylidene)amino] N-methyl-N-(trichloromethylsulfanyl)carbamate
Also Known As: 3,4-Dimethyl-2,5-thiomorpholinedione 2-(O-((methyl((trichloromethyl)thio)amino)carbonyl)oxime)
| Molecular Formula | C9H12Cl3N3O3S2 |
|---|---|
| Molecular Weight | 378.94 g/mol |
| LogP | 2.9379 |
| Topological Polar Surface Area | 62.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 378.93857 |
| Heavy Atoms | 20 |
| Complexity | 430.39618 |
Chemical Identifiers
| CAS Number | 66637-35-2 |
|---|---|
| SMILES | CC1C(=NOC(=O)N(C)SC(Cl)(Cl)Cl)SCC(=O)N1C |
Product Overview
CAS 66637-35-2 - C9H12Cl3N3O3S2 (CAS 66637-35-2), with molecular formula C9H12Cl3N3O3S2 and molecular weight 378.94 g/mol. IUPAC: [(3,4-dimethyl-5-oxothiomorpholin-2-ylidene)amino] N-methyl-N-(trichloromethylsulfanyl)carbamate.
Chemical Property Profile of CAS 66637-35-2 - C9H12Cl3N3O3S2
Property Insights of CAS 66637-35-2 - C9H12Cl3N3O3S2
The XLogP value of 2.9379 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CAS 66637-35-2 - C9H12Cl3N3O3S2. The TPSA of 62.21 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 66637-35-2 - C9H12Cl3N3O3S2. Following Lipinski's Rule of Five, CAS 66637-35-2 - C9H12Cl3N3O3S2 has 0 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 CAS 66637-35-2 - C9H12Cl3N3O3S2?
The CAS number of CAS 66637-35-2 - C9H12Cl3N3O3S2 is 66637-35-2.
What is the molecular formula of CAS 66637-35-2 - C9H12Cl3N3O3S2?
The molecular formula of CAS 66637-35-2 - C9H12Cl3N3O3S2 is C9H12Cl3N3O3S2.
What is the molecular weight of CAS 66637-35-2 - C9H12Cl3N3O3S2?
The molecular weight of CAS 66637-35-2 - C9H12Cl3N3O3S2 is 378.94 g/mol.
Where can I buy CAS 66637-35-2 - C9H12Cl3N3O3S2?
You can request a quote for CAS 66637-35-2 - C9H12Cl3N3O3S2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 66637-35-2 - C9H12Cl3N3O3S2?
Yes, KEHONG BIO provides custom synthesis services for CAS 66637-35-2 - C9H12Cl3N3O3S2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.