RefChem:237785
TL;DR: RefChem:237785 (CAS 62715-13-3) is a chemical compound with molecular formula C18H19Cl2NS and molecular weight 351.06152 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
17-chloro-3,3-dimethyl-13-thia-3-azoniatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),7,9,11,15,17-hexaene chloride
Also Known As: 1H-Dibenzo(2,3:6,7)thiepino(4,5-b)pyrrolium, 2,3,3a,12b-tetrahydro-11-chloro-1,1-dimethyl-, chloride, hydrate, 11-Chloro-1,1-dimethyl-2,3,3a,12b-tetrahydro-1H-dibenzo[2,3:6,7]thiepino[4,5-b]pyrrol-1-ium chloride, 1H-DIBENZO(2,3:6,7)THIEPINO(4,5-b)PYRROLIUM, 2,3,3a,12b-TETRAHYDRO-11-CHLORO-1,1
Technical Specifications
| Molecular Formula | C18H19Cl2NS |
| Molecular Weight | 351.06152 g/mol |
| XLogP | 2.11 |
| Topological Polar Surface Area (TPSA) | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 351.06152 Da |
| Heavy Atoms | 22 |
| Complexity | 399.0 |
| SMILES | C[N+]1(CCC2C1C3=C(C=CC(=C3)Cl)SC4=CC=CC=C24)C.[Cl-] |
| InChIKey | YOMVXIZLLCLPHE-UHFFFAOYSA-M |
Chemical Property Profile of RefChem:237785
Property Insights of RefChem:237785
The XLogP value of 2.11 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:237785. With a topological polar surface area (TPSA) of 25.3 Ų, RefChem:237785 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:237785 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:237785?
The CAS number of RefChem:237785 is 62715-13-3.
What is the molecular formula of RefChem:237785?
The molecular formula of RefChem:237785 is C18H19Cl2NS.
What is the molecular weight of RefChem:237785?
The molecular weight of RefChem:237785 is 351.06152 g/mol.
Where can I buy RefChem:237785?
You can request a quote for RefChem:237785 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:237785?
Yes, CoreyChem provides custom synthesis services for RefChem:237785 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.