RefChem:1088194
TL;DR: RefChem:1088194 (CAS 134186-17-7) is a chemical compound with molecular formula C15H20ClN3O7 and molecular weight 389.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,3aR,6S,6aS)-3-[4-(furan-2-carbonyl)piperazin-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate;hydrochloride
Also Known As: 5-Deoxy-5-(4-(furan-2-yl)carbonylpiperazin-1-yl)-1,4:3,6-dianhydro-L-iditol 2-nitrate HCl, L-Iditol, 1,4:3,6-dianhydro-2-deoxy-2-(4-(2-furanylcarbonyl)-1-piperazinyl)-, 5-nitrate, hydrochloride, 5-Deoxy-5-(4-(furan-3-yl)carbonylpiperazin-1-yl)-1,4:3,6-dianhydro-L-iditol 2-nitrate HCl, L-Iditol, 1,4:3,6-dianhydro-2-deoxy-2-(4-(3-furanylcarbonyl)-1-piperazinyl)-, 5-nitrate, hydrochloride, [(3S,3aR,6S,6aS)-3-[4-(furan-2-carbonyl)piperazin-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate hydrochloride
| Molecular Formula | C15H20ClN3O7 |
|---|---|
| Molecular Weight | 389.10 g/mol |
| LogP | 0.2023 |
| Topological Polar Surface Area | 107.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.09897 |
| Heavy Atoms | 26 |
| Complexity | 635.19434 |
Chemical Identifiers
| CAS Number | 134186-17-7 |
|---|---|
| SMILES | C1CN(CCN1[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3O[N+](=O)[O-])C(=O)C4=CC=CO4.Cl |
Product Overview
RefChem:1088194 (CAS 134186-17-7), with molecular formula C15H20ClN3O7 and molecular weight 389.10 g/mol. IUPAC: [(3S,3aR,6S,6aS)-3-[4-(furan-2-carbonyl)piperazin-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate;hydrochloride.
Chemical Property Profile of RefChem:1088194
Property Insights of RefChem:1088194
The XLogP value of 0.2023 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1088194. The TPSA of 107.52 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1088194. Following Lipinski's Rule of Five, RefChem:1088194 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1088194?
The CAS number of RefChem:1088194 is 134186-17-7.
What is the molecular formula of RefChem:1088194?
The molecular formula of RefChem:1088194 is C15H20ClN3O7.
What is the molecular weight of RefChem:1088194?
The molecular weight of RefChem:1088194 is 389.10 g/mol.
Where can I buy RefChem:1088194?
You can request a quote for RefChem:1088194 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1088194?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1088194 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.