2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate
TL;DR: 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate (CAS 51172-55-5) is a chemical compound with molecular formula C15H23NO7S and molecular weight 361.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-amino-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methanol;4-methylbenzenesulfonic acid
Also Known As: starbld0001352, 1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine, (6-Amino-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)methanol 4-methylbenzenesulfonate, 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate, 2,3-O-ISOPROPYLIDENE-beta-D-RIBOFURANOSYLAMINE
| Molecular Formula | C15H23NO7S |
|---|---|
| Molecular Weight | 361.12 g/mol |
| LogP | 0.42412 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 361.11954 |
| Heavy Atoms | 24 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 51172-55-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O.CC1(OC2C(OC(C2O1)N)CO)C |
| InChIKey | PMPFITJXVRJPKJ-UHFFFAOYSA-N |
Product Overview
2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate (CAS 51172-55-5), with molecular formula C15H23NO7S and molecular weight 361.12 g/mol. IUPAC: (4-amino-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methanol;4-methylbenzenesulfonic acid.
Chemical Property Profile of 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate
Property Insights of 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate
The XLogP value of 0.42412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate. Following Lipinski's Rule of Five, 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate has 3 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 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate?
The CAS number of 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate is 51172-55-5.
What is the molecular formula of 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate?
The molecular formula of 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate is C15H23NO7S.
What is the molecular weight of 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate?
The molecular weight of 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate is 361.12 g/mol.
Where can I buy 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate?
You can request a quote for 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2,3-O-(1-Methylethylidene)pentofuranosylamine 4-Methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.