TL;DR: RefChem:385362 (CAS 146674-56-8) is a chemical compound with molecular formula C28H29NO3S2 and molecular weight 491.15887 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(4aR,7aR)-4,4-bis(phenylsulfanyl)-2,3,4a,5,7,7a-hexahydropyrano[2,3-c]pyrrol-6-yl]-2-(2-methoxyphenyl)ethanone
Also Known As: Thiopyrano(2,3-c)pyrrole, octahydro-4,4-diphenyl-6-((2-methoxyphenyl)acetyl)-, cis-(+-)-, cis-(+-)-Octahydro-4,4-diphenyl-6-((2-methoxyphenyl)acetyl)thiopyrano(2,3-c)pyrrole, Diphenyl-4,4 ((methoxy-2 phenyl)acetyl)-6 perhydrothiopyrano(2,3-c)pyrrole-(4aRS,7aRS)-, 1-[(4aR,7aR)-4,4-bis(phenylsulfanyl)-2,3,4a,5,7,7a-hexahydropyrano[2,3-c]pyrrol-6-yl]-2-(2-methoxyphenyl)ethanone, 1-[(4aR,7aR)-4,4-Bis(phenylsulfanyl)hexahydropyrano[2,3-c]pyrrol-6(2H)-yl]-2-(2-methoxyphenyl)ethan-1-one
| Molecular Formula | C28H29NO3S2 |
| Molecular Weight | 491.15887 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 89.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 491.15887 Da |
| Heavy Atoms | 34 |
| Complexity | 644.0 |
| SMILES | COC1=CC=CC=C1CC(=O)N2C[C@@H]3[C@H](C2)OCCC3(SC4=CC=CC=C4)SC5=CC=CC=C5 |
| InChIKey | ZWDCFLGAHKBNKN-RSXGOPAZSA-N |
The XLogP value of 5.8 indicates that RefChem:385362 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:385362. Following Lipinski's Rule of Five, RefChem:385362 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:385362 is 146674-56-8.
The molecular formula of RefChem:385362 is C28H29NO3S2.
The molecular weight of RefChem:385362 is 491.15887 g/mol.
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