BAS 00133982
TL;DR: BAS 00133982 (CAS 301358-62-3) is a chemical compound with molecular formula C14H17Cl3N2O3S and molecular weight 398.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-[2,2,2-trichloro-1-[(1,1-dioxothiolan-3-yl)amino]ethyl]benzamide
Also Known As: BAS 00133982, 2-methyl-N-{2,2,2-trichloro-1-[(1,1-dioxidotetrahydrothiophen-3-yl)amino]ethyl}benzamide, 2-ME-N-(2,2,2-TRICHLORO-1-(1,1-DIOXO-4H-THIOPHEN-3-YLAMINO)-ETHYL)-BENZAMIDE, 2-methyl-N-(2,2,2-trichloro-1-((1,1-dioxidotetrahydrothiophen-3-yl)amino)ethyl)benzamide, 2-methyl-N-[2,2,2-trichloro-1-[(1,1-dioxothiolan-3-yl)amino]ethyl]benzamide
| Molecular Formula | C14H17Cl3N2O3S |
|---|---|
| Molecular Weight | 398.00 g/mol |
| LogP | 2.19782 |
| Topological Polar Surface Area | 75.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.00253 |
| Heavy Atoms | 23 |
| Complexity | 688.75305 |
Chemical Identifiers
| CAS Number | 301358-62-3 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NC(C(Cl)(Cl)Cl)NC2CCS(=O)(=O)C2 |
Product Overview
BAS 00133982 (CAS 301358-62-3), with molecular formula C14H17Cl3N2O3S and molecular weight 398.00 g/mol. IUPAC: 2-methyl-N-[2,2,2-trichloro-1-[(1,1-dioxothiolan-3-yl)amino]ethyl]benzamide.
Chemical Property Profile of BAS 00133982
Property Insights of BAS 00133982
The XLogP value of 2.19782 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00133982. The TPSA of 75.27 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00133982. Following Lipinski's Rule of Five, BAS 00133982 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 BAS 00133982?
The CAS number of BAS 00133982 is 301358-62-3.
What is the molecular formula of BAS 00133982?
The molecular formula of BAS 00133982 is C14H17Cl3N2O3S.
What is the molecular weight of BAS 00133982?
The molecular weight of BAS 00133982 is 398.00 g/mol.
Where can I buy BAS 00133982?
You can request a quote for BAS 00133982 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00133982?
Yes, KEHONG BIO provides custom synthesis services for BAS 00133982 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.