![ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate structure](/static/products/6494/64949-91-3.webp)
ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate
TL;DR: ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate (CAS 64949-91-3) is a chemical compound with molecular formula C37H35N3O4S2 and molecular weight 649.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate
Also Known As: ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate, Ethyl N-[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]-S-(triphenylmethyl)cysteinate
| Molecular Formula | C37H35N3O4S2 |
|---|---|
| Molecular Weight | 649.21 g/mol |
| LogP | 7.5 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 15 |
| Exact Mass | 649.2069 |
| Heavy Atoms | 46 |
| Complexity | 913.0 |
Chemical Identifiers
| CAS Number | 64949-91-3 |
|---|---|
| SMILES | CCOC(=O)C(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CSC(=N4)CCNC(=O)C5=CC=CC=C5 |
| InChIKey | OFAIWYIMSPBJQO-UHFFFAOYSA-N |
Product Overview
ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate (CAS 64949-91-3), with molecular formula C37H35N3O4S2 and molecular weight 649.21 g/mol. IUPAC: ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate.
Chemical Property Profile of ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate
Property Insights of ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate
The XLogP value of 7.5 indicates that ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 151.0 Ų indicates high polarity, suggesting ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate has 2 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 ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate?
The CAS number of ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate is 64949-91-3.
What is the molecular formula of ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate?
The molecular formula of ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate is C37H35N3O4S2.
What is the molecular weight of ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate?
The molecular weight of ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate is 649.21 g/mol.
Where can I buy ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate?
You can request a quote for ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.