C12H15Cl3N2O2S
TL;DR: C12H15Cl3N2O2S (CAS 324070-04-4) is a chemical compound with molecular formula C12H15Cl3N2O2S and molecular weight 355.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2,2,2-trichloro-1-(oxolan-2-ylmethylamino)ethyl]thiophene-2-carboxamide
Also Known As: BAS 00392332, N-[2,2,2-trichloro-1-(oxolan-2-ylmethylamino)ethyl]thiophene-2-carboxamide, 2-thienyl-N-{2,2,2-trichloro-1-[(oxolan-2-ylmethyl)amino]ethyl}carboxamide, N-(2,2,2-trichloro-1-(((tetrahydrofuran-2-yl)methyl)amino)ethyl)thiophene-2-carboxamide, N-{2,2,2-trichloro-1-[(tetrahydro-2-furanylmethyl)amino]ethyl}-2-thiophenecarboxamide
| Molecular Formula | C12H15Cl3N2O2S |
|---|---|
| Molecular Weight | 355.99 g/mol |
| LogP | 2.9428 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 355.99197 |
| Heavy Atoms | 20 |
| Complexity | 430.4109 |
Chemical Identifiers
| CAS Number | 324070-04-4 |
|---|---|
| SMILES | C1CC(OC1)CNC(C(Cl)(Cl)Cl)NC(=O)C2=CC=CS2 |
Product Overview
C12H15Cl3N2O2S (CAS 324070-04-4), with molecular formula C12H15Cl3N2O2S and molecular weight 355.99 g/mol. IUPAC: N-[2,2,2-trichloro-1-(oxolan-2-ylmethylamino)ethyl]thiophene-2-carboxamide.
Chemical Property Profile of C12H15Cl3N2O2S
Property Insights of C12H15Cl3N2O2S
The XLogP value of 2.9428 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C12H15Cl3N2O2S. With a topological polar surface area (TPSA) of 50.36 Ų, C12H15Cl3N2O2S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C12H15Cl3N2O2S has 2 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 C12H15Cl3N2O2S?
The CAS number of C12H15Cl3N2O2S is 324070-04-4.
What is the molecular formula of C12H15Cl3N2O2S?
The molecular formula of C12H15Cl3N2O2S is C12H15Cl3N2O2S.
What is the molecular weight of C12H15Cl3N2O2S?
The molecular weight of C12H15Cl3N2O2S is 355.99 g/mol.
Where can I buy C12H15Cl3N2O2S?
You can request a quote for C12H15Cl3N2O2S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C12H15Cl3N2O2S?
Yes, KEHONG BIO provides custom synthesis services for C12H15Cl3N2O2S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.