HOCH2CH2 isostere
[(2R,3R)-1,1-dioxo-2-propan-2-ylthiolan-3-yl] N-[(2S,3R)-4-[(3aR,6S,7aS)-6-(tert-butylcarbamoyl)-3,3a,4,6,7,7a-hexahydro-2H-thieno[3,2-c]pyridin-5-yl]-3-hydroxy-1-phenylbutan-2-yl]carbamate
Also Known As: HOCH2CH2 isostere|ThienopyridCON thienyl urethane deriv.|Thienopyridine thienyl urethane deriv. 14|5-(3(R)-(((2(R)-cis-Isopropyl-1,1-dioxotetrahydrothienyl-3(R)-oxy)carbonyl)amino)-4-phenyl-2(R)-hydroxybutyl)-N-(1,1-dimethylethyl)octahydrothieno(3,2-c)pyridine-6(R)-carboxamide|(2R,3R)-1,1-Dioxo-2-(propan-2-yl)-1lambda~6~-thiolan-3-yl {(2S,3R)-4-[(3aR,6S,7aS)-6-(tert-butylcarbamoyl)hexahydrothieno[3,2-c]pyridin-5(4H)-yl]-3-hydroxy-1-phenylbutan-2-yl}carbamate|[(1S,2R)-1-Benzyl-3-((3aR,6S,7aS)-6-tert-butylcarbamoyl-hexahydro-thieno[3,2-c]pyridin-5-yl)-2-hydroxy-propyl]-carbamic acid (2R,3R)-2-isopropyl-1,1-dioxo-tetrahydro-1lambda*6*-thiophen-3-yl ester|[(2R,3R)-1,1-dioxo-2-propan-2-ylthiolan-3-yl] N-[(2S,3R)-4-[(3aR,6S,7aS)-6-(tert-butylcarbamoyl)-3,3a,4,6,7,7a-hexahydro-2H-thieno[3,2-c]pyridin-5-yl]-3-hydroxy-1-phenylbutan-2-yl]carbamate|[(2R,3R)-2-isopropyl-1,1-dioxo-thiolan-3-yl] N-[(1S,2R)-3-[(3aR,6S,7aS)-6-(tert-butylcarbamoyl)-3,3a,4,6,7,7a-hexahydro-2H-thieno[3,2-c]pyridin-5-yl]-1-benzyl-2-hydroxy-propyl]carbamate|5-[3(R)-[[(2(R)-cis-Isopropyl-1,1-dioxotetrahydrothienyl-3(R)-oxy)carbonyl]amino]-4-phenyl-2(R)-hydroxybutyl]-N-(1,1-dimethylethyl)octahydrothieno[3,2-c]pyridine-6(R)-carboxamide
| Molecular Formula | C30H47N3O6S2 |
|---|---|
| Molecular Weight | 609.29065 g/mol |
| LogP | 3.0072 |
| Topological Polar Surface Area | 125.04 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 609.29065 |
| Monoisotopic Mass | 609.29065 |
| Heavy Atoms | 41 |
| Complexity | 1156.5078 |
Chemical Identifiers
| CAS Number | 174173-75-2 |
|---|---|
| SMILES | CC(C)[C@@H]1[C@@H](CCS1(=O)=O)OC(=O)N[C@@H](CC2=CC=CC=C2)[C@@H](CN3C[C@H]4CCS[C@H]4C[C@H]3C(=O)NC(C)(C)C)O |
Product Overview
HOCH2CH2 isostere (CAS 174173-75-2), with molecular formula C30H47N3O6S2 and molecular weight 609.29065 g/mol. IUPAC: [(2R,3R)-1,1-dioxo-2-propan-2-ylthiolan-3-yl] N-[(2S,3R)-4-[(3aR,6S,7aS)-6-(tert-butylcarbamoyl)-3,3a,4,6,7,7a-hexahydro-2H-thieno[3,2-c]pyridin-5-yl]-3-hydroxy-1-phenylbutan-2-yl]carbamate.
Frequently Asked Questions
📚 Academic Support
Scientific research papers and technical documentation supporting this product for informed procurement decisions.
Technical Blog Article
Multi-source research profile: chemical properties, regulatory status, and sourcing guide for HOCH2CH2 isostere.
Read Full Article →No research papers found for this product yet.
We continuously update our academic references. Check back soon!