Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride
TL;DR: Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride (CAS 117125-53-8) is a chemical compound with molecular formula C18H20ClNO2S and molecular weight 349.09033 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-(6,11-dihydrobenzo[c][1]benzothiepin-11-ylamino)acetate;hydrochloride
Also Known As: Ethyl 2-(6,11-dihydrodibenzo(b,e)thiepin-11-ylamino)acetate hydrochloride, N-(6,11-Dihydrodibenzo(b,e)thiepin-11-yl)glycine ethyl ester hydrochloride, Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride, ethyl 2-(6,11-dihydrobenzo[c][1]benzothiepin-11-ylamino)acetate hydrochloride, Ethyl N-(6,11-dihydrodibenzo[b,e]thiepin-11-yl)glycinate--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C18H20ClNO2S |
| Molecular Weight | 349.09033 g/mol |
| XLogP | 3.9562 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.09033 Da |
| Heavy Atoms | 23 |
| Complexity | 376.0 |
| SMILES | CCOC(=O)CNC1C2=CC=CC=C2CSC3=CC=CC=C13.Cl |
| InChIKey | PSAWGQATHZKSPQ-UHFFFAOYSA-N |
Chemical Property Profile of Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride
Property Insights of Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride
The XLogP value of 3.9562 indicates that Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride. Following Lipinski's Rule of Five, Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride 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
What is the CAS number of Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride?
The CAS number of Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride is 117125-53-8.
What is the molecular formula of Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride?
The molecular formula of Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride is C18H20ClNO2S.
What is the molecular weight of Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride?
The molecular weight of Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride is 349.09033 g/mol.
Where can I buy Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride?
You can request a quote for Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.