RS 5773
TL;DR: RS 5773 (CAS 129173-57-5) is a chemical compound with molecular formula C27H31ClN2O4S2 and molecular weight 546.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-8-(thiophen-2-ylmethyl)-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate;hydrochloride
Also Known As: RS 5773, (2S-cis)-3-(Acetyloxy)-5-(2-(dimethylamino)ethyl)-2,3-dihydro-2-(4-methoxyphenyl)-8-(2-thienylmethyl)-1,5-benzothiazepin-4(5H)-one monohydrochloride, [(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-8-(thiophen-2-ylmethyl)-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate;hydrochloride, 3-Acetoxy-8-benzyl-2,3-dihydro-5-(2-(dimethylamino)ethyl)-2-(4-methoxyphenyl)-1,5-benzothiazepine-4-(5H)-one hcl, (2S,3S)-5-(2-(dimethylamino)ethyl)-2-(4-methoxyphenyl)-4-oxo-8-(thiophen-2-ylmethyl)-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl acetate hydrochloride
| Molecular Formula | C27H31ClN2O4S2 |
|---|---|
| Molecular Weight | 546.14 g/mol |
| LogP | 5.4426 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 546.14136 |
| Heavy Atoms | 36 |
| Complexity | 715.0 |
Chemical Identifiers
| CAS Number | 129173-57-5 |
|---|---|
| SMILES | CC(=O)O[C@@H]1[C@@H](SC2=C(C=CC(=C2)CC3=CC=CS3)N(C1=O)CCN(C)C)C4=CC=C(C=C4)OC.Cl |
| InChIKey | UUYRJDKLOCCAMI-QGLFPKSOSA-N |
Product Overview
RS 5773 (CAS 129173-57-5), with molecular formula C27H31ClN2O4S2 and molecular weight 546.14 g/mol. IUPAC: [(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-8-(thiophen-2-ylmethyl)-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate;hydrochloride.
Chemical Property Profile of RS 5773
Property Insights of RS 5773
The XLogP value of 5.4426 indicates that RS 5773 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RS 5773. Following Lipinski's Rule of Five, RS 5773 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RS 5773?
The CAS number of RS 5773 is 129173-57-5.
What is the molecular formula of RS 5773?
The molecular formula of RS 5773 is C27H31ClN2O4S2.
What is the molecular weight of RS 5773?
The molecular weight of RS 5773 is 546.14 g/mol.
Where can I buy RS 5773?
You can request a quote for RS 5773 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RS 5773?
Yes, KEHONG BIO provides custom synthesis services for RS 5773 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.